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CAS 1001635-30-8 3-Amino-5-methylpyridine-2-carbonitrile molecular structure lightbox
CAS RN: 1001635-30-8

3-Amino-5-methylpyridine-2-carbonitrile

Product Availability

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250225 1g In stock Inquiry
Batchno.20250204 250mg In stock Inquiry
Batchno.20260505 5g In stock Inquiry
  • Product code: SSC-000565
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 5g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1001635-30-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Beijing Inquiry

1001635-30-8 / 3-amino-5-methylpyridine-2-carbonitrile

3-Amino-5-methylpyridine-2-carbonitrile | DTXSID30694118 | RefChem:276547

Standard CAS: 1001635-30-8 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1001635-30-8
Multi CAS
No
Molecular Formula
C7H7N3
Molecular Weight
133.150000
Exact Mass
133.063997
SMILES
CC1=CC(=C(N=C1)C#N)N
InChI
InChI=1S/C7H7N3/c1-5-2-6(9)7(3-8)10-4-5/h2,4H,9H2,1H3
InChIKey
KTVNTMJPGTZBRH-UHFFFAOYSA-N
Synonyms
3-Amino-5-methylpyridine-2-carbonitrile DTXSID30694118 RefChem:276547 DTXCID00644867 691-805-1

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.14
H-bond acceptors
3
H-bond donors
1
Molar refractivity
38.1
TPSA
62.7

LogP / Solubility

WLOGP
0.84
MLOGP
0.73
XLogP3
1.1
Consensus LogP
0.89
Log S (ESOL)
-1.64
Class (ESOL)
Soluble
Log S (Ali)
-1.26
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.23
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.93

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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