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CAS 1197404-30-0 2-AMino-5-[(diMethylaMino)Methyl]pyridine molecular structure lightbox
CAS RN: 1197404-30-0

2-AMino-5-[(diMethylaMino)Methyl]pyridine

  • Product code: SSC-020485
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g
  • Available purity: >95%
  • Inventory rows with stock: 2
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1197404-30-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 1 In Stock Shenzhen Inquiry
0.25g >95% 1 In Stock Beijing Inquiry
1g >95% 0 Out of Stock Shanghai Inquiry

1197404-30-0 / 5-[(dimethylamino)methyl]pyridin-2-amine

5-[(dimethylamino)methyl]pyridin-2-amine | 5-((Dimethylamino)methyl)pyridin-2-amine | RefChem:528759

Standard CAS: 1197404-30-0 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1197404-30-0
Multi CAS
No
Molecular Formula
C8H13N3
Molecular Weight
151.210000
Exact Mass
151.110947
SMILES
CN(C)CC1=CN=C(C=C1)N
InChI
InChI=1S/C8H13N3/c1-11(2)6-7-3-4-8(9)10-5-7/h3-5H,6H2,1-2H3,(H2,9,10)
InChIKey
SDVRXHFNSQTUGR-UHFFFAOYSA-N
Synonyms
5-[(dimethylamino)methyl]pyridin-2-amine 5-((Dimethylamino)methyl)pyridin-2-amine RefChem:528759 855-727-3 2-Amino-5-[(dimethylamino)methyl]pyridine

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.38
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
46.04
TPSA
42.15

LogP / Solubility

WLOGP
0.73
MLOGP
0.63
XLogP3
0.5
Consensus LogP
0.62
Log S (ESOL)
-1.51
Class (ESOL)
Soluble
Log S (Ali)
-1.32
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.48
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)
-3.13

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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