2-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-carboxamide

C13H19N3O — CID 79043281

IUPAC2-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-carboxamide
SMILESCc1ncccc1NC(=O)C1CCCC1CN
InChIInChI=1S/C13H19N3O/c1-9-12(6-3-7-15-9)16-13(17)11-5-2-4-10(11)8-14/h3,6-7,10-11H,2,4-5,8,14H2,1H3,(H,16,17)
InChIKeyJVOIJOMRTDVROT-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.70
Rot. Bonds3

About 2-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-carboxamide

2-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-carboxamide (PubChem CID 79043281) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-carboxamide
PubChem CID79043281
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name2-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-carboxamide
SMILESCc1ncccc1NC(=O)C1CCCC1CN
InChIInChI=1S/C13H19N3O/c1-9-12(6-3-7-15-9)16-13(17)11-5-2-4-10(11)8-14/h3,6-7,10-11H,2,4-5,8,14H2,1H3,(H,16,17)
InChIKeyJVOIJOMRTDVROT-UHFFFAOYSA-N
XLogP1.70
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 ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-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-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-carboxamide?
The IUPAC name of 2-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-carboxamide (CID 79043281) is 2-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-carboxamide?
The canonical SMILES for 2-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-carboxamide is Cc1ncccc1NC(=O)C1CCCC1CN.
What is the InChIKey of 2-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-carboxamide?
The InChIKey is JVOIJOMRTDVROT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-9-12(6-3-7-15-9)16-13(17)11-5-2-4-10(11)8-14/h3,6-7,10-11H,2,4-5,8,14H2,1H3,(H,16,17).
What are the key properties of 2-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-carboxamide?
2-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.70, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(2-methyl-3-pyridinyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 79043281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).