3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide

C13H19N3O — CID 107420601

IUPAC3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide
SMILESCC1CCCC1CNC(=O)c1ccncc1N
InChIInChI=1S/C13H19N3O/c1-9-3-2-4-10(9)7-16-13(17)11-5-6-15-8-12(11)14/h5-6,8-10H,2-4,7,14H2,1H3,(H,16,17)
InChIKeyBKAMZURKALPYKO-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.83
Rot. Bonds3

About 3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide

3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide (PubChem CID 107420601) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide
PubChem CID107420601
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide
SMILESCC1CCCC1CNC(=O)c1ccncc1N
InChIInChI=1S/C13H19N3O/c1-9-3-2-4-10(9)7-16-13(17)11-5-6-15-8-12(11)14/h5-6,8-10H,2-4,7,14H2,1H3,(H,16,17)
InChIKeyBKAMZURKALPYKO-UHFFFAOYSA-N
XLogP1.83
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-hydrazinyl-N-[(2-methylcyclohexyl)methyl]pyridine-3-carboxamide
CID 81256731
5-amino-N-[(2-methylcyclopentyl)methyl]-1H-pyrazole-4-carboxamide
CID 107420177
3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide
CID 105070285
2-(methylamino)-N-[(2-methylcyclopentyl)methyl]benzamide
CID 107419522
2-amino-5-chloro-N-[(2-methylcyclohexyl)methyl]benzamide
CID 55013606
3-amino-2-chloro-N-[(2-methylcyclohexyl)methyl]benzamide
CID 112575789
6-hydrazinyl-N-[(2-methylcyclopentyl)methyl]pyridine-3-carboxamide
CID 107420650
2-[[(3-methoxypyridine-4-carbonyl)amino]methyl]cyclopentane-1-carboxylic acid
CID 105063230
5-amino-N-[(2-methylcyclopentyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide
CID 107421062
3-amino-N-(2-methylpropyl)pyridine-4-carboxamide
CID 110848376
2-chloro-5-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide
CID 107418935
2-(aminomethyl)-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide
CID 107418474

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide?
The IUPAC name of 3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide (CID 107420601) is 3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for 3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide?
The canonical SMILES for 3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide is CC1CCCC1CNC(=O)c1ccncc1N.
What is the InChIKey of 3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide?
The InChIKey is BKAMZURKALPYKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-9-3-2-4-10(9)7-16-13(17)11-5-6-15-8-12(11)14/h5-6,8-10H,2-4,7,14H2,1H3,(H,16,17).
What are the key properties of 3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide?
3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.83, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 107420601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).