N-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide

C14H21N3O2 — CID 106124683

IUPACN-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide
SMILESCOc1ncccc1C(=O)NCC1CCC(N)CC1
InChIInChI=1S/C14H21N3O2/c1-19-14-12(3-2-8-16-14)13(18)17-9-10-4-6-11(15)7-5-10/h2-3,8,10-11H,4-7,9,15H2,1H3,(H,17,18)
InChIKeyWFOGOPBCGJKFNT-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.34
Rot. Bonds4

About N-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide

N-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide (PubChem CID 106124683) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide
PubChem CID106124683
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide
SMILESCOc1ncccc1C(=O)NCC1CCC(N)CC1
InChIInChI=1S/C14H21N3O2/c1-19-14-12(3-2-8-16-14)13(18)17-9-10-4-6-11(15)7-5-10/h2-3,8,10-11H,4-7,9,15H2,1H3,(H,17,18)
InChIKeyWFOGOPBCGJKFNT-UHFFFAOYSA-N
XLogP1.34
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(4-bromocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide
CID 114148107
N-[(1-benzylpiperidin-4-yl)methyl]-2-methoxypyridine-3-carboxamide
CID 136579147
2-methoxy-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide
CID 55126271
N-[[2-(chloromethyl)cyclopentyl]methyl]-2-methoxypyridine-3-carboxamide
CID 113273848
N-(2-hydroxy-2-methylpropyl)-2-methoxypyridine-3-carboxamide
CID 65109453
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methoxypyridine-3-carboxamide
CID 113313670
N-[(4-aminocyclohexyl)methyl]-2-hydroxy-3-methylbenzamide
CID 106124188
N-(3-chloropropyl)-2-methoxypyridine-3-carboxamide
CID 62873972
N-[(2-hydroxyphenyl)methyl]-2-methoxypyridine-3-carboxamide
CID 115598782
N-(2-amino-3-hydroxybutyl)-2-methoxypyridine-3-carboxamide
CID 64541044
N-(5-hydroxypentyl)-2-methoxypyridine-3-carboxamide
CID 107318362
N-(3-bromo-2,2-dimethylpropyl)-2-methoxypyridine-3-carboxamide
CID 115364804

Frequently Asked Questions

What is the IUPAC name of N-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide?
The IUPAC name of N-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide (CID 106124683) is N-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide.
What is the SMILES notation for N-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide?
The canonical SMILES for N-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide is COc1ncccc1C(=O)NCC1CCC(N)CC1.
What is the InChIKey of N-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide?
The InChIKey is WFOGOPBCGJKFNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-19-14-12(3-2-8-16-14)13(18)17-9-10-4-6-11(15)7-5-10/h2-3,8,10-11H,4-7,9,15H2,1H3,(H,17,18).
What are the key properties of N-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide?
N-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.34, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-aminocyclohexyl)methyl]-2-methoxypyridine-3-carboxamide is sourced from PubChem (CID 106124683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).