N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide

C15H23N3O — CID 81245301

IUPACN-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccncc1C(=O)NC1(C)CCCC1
InChIInChI=1S/C15H23N3O/c1-3-9-17-13-6-10-16-11-12(13)14(19)18-15(2)7-4-5-8-15/h6,10-11H,3-5,7-9H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyOKBWEBJNUOIQDZ-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.97
Rot. Bonds5

About N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide

N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide (PubChem CID 81245301) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide
PubChem CID81245301
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccncc1C(=O)NC1(C)CCCC1
InChIInChI=1S/C15H23N3O/c1-3-9-17-13-6-10-16-11-12(13)14(19)18-15(2)7-4-5-8-15/h6,10-11H,3-5,7-9H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyOKBWEBJNUOIQDZ-UHFFFAOYSA-N
XLogP2.97
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-N-(1-methylcyclohexyl)-4-(propylamino)pyridine-3-carboxamide
CID 81238446
N-(4,4-dimethylcyclohexyl)-4-(propylamino)pyridine-3-carboxamide
CID 81235124
5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide
CID 63499534
4-(propylamino)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-carboxamide
CID 81244963
(4,4-dimethylpiperidin-1-yl)-[4-(propylamino)-3-pyridinyl]methanone
CID 81240564
4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
CID 81240630
3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide
CID 105386620
5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide
CID 113485988
N-[2-(carbamoylamino)ethyl]-4-(propylamino)pyridine-3-carboxamide
CID 83115001
N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-(propylamino)pyridine-3-carboxamide
CID 106280042
(3-hydroxy-3-methylpyrrolidin-1-yl)-[4-(propylamino)-3-pyridinyl]methanone
CID 103358219
N-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide
CID 81237252

Frequently Asked Questions

What is the IUPAC name of N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide (CID 81245301) is N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide is CCCNc1ccncc1C(=O)NC1(C)CCCC1.
What is the InChIKey of N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide?
The InChIKey is OKBWEBJNUOIQDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-9-17-13-6-10-16-11-12(13)14(19)18-15(2)7-4-5-8-15/h6,10-11H,3-5,7-9H2,1-2H3,(H,16,17)(H,18,19).
What are the key properties of N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide?
N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.97, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 81245301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).