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CAS 1203295-89-9 N-((6-Aminopyridin-2-yl)methyl)acetamide molecular structure lightbox
CAS RN: 1203295-89-9

N-((6-Aminopyridin-2-yl)methyl)acetamide

  • Product code: SSC-021185
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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: 0.25g
  • Available purity: ≥95%
  • 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 1203295-89-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Hong Kong Inquiry

1203295-89-9 / N-[(6-amino-2-pyridinyl)methyl]acetamide

N-((6-AMINOPYRIDIN-2-YL)METHYL)ACETAMIDE | N-[(6-aminopyridin-2-yl)methyl]acetamide | MFCD12827702

Standard CAS: 1203295-89-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1203295-89-9
Multi CAS
No
Molecular Formula
C8H11N3O
Molecular Weight
165.190000
Exact Mass
165.090212
SMILES
CC(=O)NCC1=NC(=CC=C1)N
InChI
InChI=1S/C8H11N3O/c1-6(12)10-5-7-3-2-4-8(9)11-7/h2-4H,5H2,1H3,(H2,9,11)(H,10,12)
InChIKey
HQSWCZDDQGJJPF-UHFFFAOYSA-N
Synonyms
N-((6-AMINOPYRIDIN-2-YL)METHYL)ACETAMIDE N-[(6-aminopyridin-2-yl)methyl]acetamide MFCD12827702 DTXSID00678485 N-[(6-amino-2-pyridyl)methyl]acetamide

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
46.17
TPSA
68.01

LogP / Solubility

WLOGP
0.3
MLOGP
0.26
XLogP3
-0.3
Consensus LogP
0.09
Log S (ESOL)
-1.29
Class (ESOL)
Soluble
Log S (Ali)
-1.13
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.22
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)
-3.51

Drug-likeness / Medicinal Chemistry

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

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