6-[(3-phenylcyclopentyl)amino]pyridine-3-carboxamide

C17H19N3O — CID 126962294

IUPAC6-[(3-phenylcyclopentyl)amino]pyridine-3-carboxamide
SMILESNC(=O)c1ccc(NC2CCC(c3ccccc3)C2)nc1
InChIInChI=1S/C17H19N3O/c18-17(21)14-7-9-16(19-11-14)20-15-8-6-13(10-15)12-4-2-1-3-5-12/h1-5,7,9,11,13,15H,6,8,10H2,(H2,18,21)(H,19,20)
InChIKeyJBSAILAEEJVXKB-UHFFFAOYSA-N
MW281.36 g/mol
LogP2.93
Rot. Bonds4

About 6-[(3-phenylcyclopentyl)amino]pyridine-3-carboxamide

6-[(3-phenylcyclopentyl)amino]pyridine-3-carboxamide (PubChem CID 126962294) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is 6-[(3-phenylcyclopentyl)amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(3-phenylcyclopentyl)amino]pyridine-3-carboxamide
PubChem CID126962294
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC Name6-[(3-phenylcyclopentyl)amino]pyridine-3-carboxamide
SMILESNC(=O)c1ccc(NC2CCC(c3ccccc3)C2)nc1
InChIInChI=1S/C17H19N3O/c18-17(21)14-7-9-16(19-11-14)20-15-8-6-13(10-15)12-4-2-1-3-5-12/h1-5,7,9,11,13,15H,6,8,10H2,(H2,18,21)(H,19,20)
InChIKeyJBSAILAEEJVXKB-UHFFFAOYSA-N
XLogP2.93
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[(3-phenylcyclopentyl)amino]pyridine-3-carboxamide?
The IUPAC name of 6-[(3-phenylcyclopentyl)amino]pyridine-3-carboxamide (CID 126962294) is 6-[(3-phenylcyclopentyl)amino]pyridine-3-carboxamide.
What is the SMILES notation for 6-[(3-phenylcyclopentyl)amino]pyridine-3-carboxamide?
The canonical SMILES for 6-[(3-phenylcyclopentyl)amino]pyridine-3-carboxamide is NC(=O)c1ccc(NC2CCC(c3ccccc3)C2)nc1.
What is the InChIKey of 6-[(3-phenylcyclopentyl)amino]pyridine-3-carboxamide?
The InChIKey is JBSAILAEEJVXKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c18-17(21)14-7-9-16(19-11-14)20-15-8-6-13(10-15)12-4-2-1-3-5-12/h1-5,7,9,11,13,15H,6,8,10H2,(H2,18,21)(H,19,20).
What are the key properties of 6-[(3-phenylcyclopentyl)amino]pyridine-3-carboxamide?
6-[(3-phenylcyclopentyl)amino]pyridine-3-carboxamide has a molecular weight of 281.36 g/mol, XLogP of 2.93, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3-phenylcyclopentyl)amino]pyridine-3-carboxamide is sourced from PubChem (CID 126962294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).