5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide

C15H23N3O — CID 106016244

IUPAC5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide
SMILESNCc1ccc(C(=O)NCCCC2CCCC2)nc1
InChIInChI=1S/C15H23N3O/c16-10-13-7-8-14(18-11-13)15(19)17-9-3-6-12-4-1-2-5-12/h7-8,11-12H,1-6,9-10,16H2,(H,17,19)
InChIKeyDEFWNICOGASOHE-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.24
Rot. Bonds6

About 5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide

5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide (PubChem CID 106016244) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide
PubChem CID106016244
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide
SMILESNCc1ccc(C(=O)NCCCC2CCCC2)nc1
InChIInChI=1S/C15H23N3O/c16-10-13-7-8-14(18-11-13)15(19)17-9-3-6-12-4-1-2-5-12/h7-8,11-12H,1-6,9-10,16H2,(H,17,19)
InChIKeyDEFWNICOGASOHE-UHFFFAOYSA-N
XLogP2.24
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-amino-N-(3-cyclopentylpropyl)pyridine-2-carboxamide
CID 106006309
5-(aminomethyl)-N-(3-pyrrolidin-1-ylpropyl)pyridine-2-carboxamide
CID 55229822
5-(3-cyclohexylpropylcarbamoyl)pyrazine-2-carboxylic acid
CID 120685018
5-(aminomethyl)-N-[3-(diethylamino)propyl]pyridine-2-carboxamide
CID 63723354
2-cyclobutylethyl 5-(aminomethyl)pyridine-2-carboxylate
CID 106203037
5-(aminomethyl)-N-(2-piperidin-1-ylethyl)pyridine-2-carboxamide
CID 63724906
4-(chloromethyl)-N-(3-cyclopentylpropyl)benzamide
CID 106009628
4-(aminomethyl)-N-(2-cyclohexylethyl)pyridine-2-carboxamide
CID 115117078
5-carbamothioyl-N-(2-cyclopentylethyl)pyridine-2-carboxamide
CID 55230785
5-(3-aminoprop-1-ynyl)-N-(2-cyclopentylethyl)pyridine-2-carboxamide
CID 62953666
6-amino-N-(3-cyclopentylpropyl)pyridine-3-carboxamide
CID 114137460
5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide
CID 63724390

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide?
The IUPAC name of 5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide (CID 106016244) is 5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide is NCc1ccc(C(=O)NCCCC2CCCC2)nc1.
What is the InChIKey of 5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide?
The InChIKey is DEFWNICOGASOHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c16-10-13-7-8-14(18-11-13)15(19)17-9-3-6-12-4-1-2-5-12/h7-8,11-12H,1-6,9-10,16H2,(H,17,19).
What are the key properties of 5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide?
5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.24, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide is sourced from PubChem (CID 106016244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).