2-[cyclopentyl(methyl)amino]pyridine-3-carboxamide

C12H17N3O — CID 67508458

IUPAC2-[cyclopentyl(methyl)amino]pyridine-3-carboxamide
SMILESCN(c1ncccc1C(N)=O)C1CCCC1
InChIInChI=1S/C12H17N3O/c1-15(9-5-2-3-6-9)12-10(11(13)16)7-4-8-14-12/h4,7-9H,2-3,5-6H2,1H3,(H2,13,16)
InChIKeyMLMMAERDGJQFGI-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.56
Rot. Bonds3

About 2-[cyclopentyl(methyl)amino]pyridine-3-carboxamide

2-[cyclopentyl(methyl)amino]pyridine-3-carboxamide (PubChem CID 67508458) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is 2-[cyclopentyl(methyl)amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[cyclopentyl(methyl)amino]pyridine-3-carboxamide
PubChem CID67508458
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC Name2-[cyclopentyl(methyl)amino]pyridine-3-carboxamide
SMILESCN(c1ncccc1C(N)=O)C1CCCC1
InChIInChI=1S/C12H17N3O/c1-15(9-5-2-3-6-9)12-10(11(13)16)7-4-8-14-12/h4,7-9H,2-3,5-6H2,1H3,(H2,13,16)
InChIKeyMLMMAERDGJQFGI-UHFFFAOYSA-N
XLogP1.56
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[cyclopentyl(methyl)amino]pyridine-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

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(methyl)amino]pyridine-3-carboxamide?
The IUPAC name of 2-[cyclopentyl(methyl)amino]pyridine-3-carboxamide (CID 67508458) is 2-[cyclopentyl(methyl)amino]pyridine-3-carboxamide.
What is the SMILES notation for 2-[cyclopentyl(methyl)amino]pyridine-3-carboxamide?
The canonical SMILES for 2-[cyclopentyl(methyl)amino]pyridine-3-carboxamide is CN(c1ncccc1C(N)=O)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl(methyl)amino]pyridine-3-carboxamide?
The InChIKey is MLMMAERDGJQFGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c1-15(9-5-2-3-6-9)12-10(11(13)16)7-4-8-14-12/h4,7-9H,2-3,5-6H2,1H3,(H2,13,16).
What are the key properties of 2-[cyclopentyl(methyl)amino]pyridine-3-carboxamide?
2-[cyclopentyl(methyl)amino]pyridine-3-carboxamide has a molecular weight of 219.29 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(methyl)amino]pyridine-3-carboxamide is sourced from PubChem (CID 67508458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).