4-(3-cyclopentylpropylamino)-N-methylpyridine-2-carboxamide

C15H23N3O — CID 106012735

IUPAC4-(3-cyclopentylpropylamino)-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1cc(NCCCC2CCCC2)ccn1
InChIInChI=1S/C15H23N3O/c1-16-15(19)14-11-13(8-10-18-14)17-9-4-7-12-5-2-3-6-12/h8,10-12H,2-7,9H2,1H3,(H,16,19)(H,17,18)
InChIKeyGQEFALGXEBSIIX-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.82
Rot. Bonds6

About 4-(3-cyclopentylpropylamino)-N-methylpyridine-2-carboxamide

4-(3-cyclopentylpropylamino)-N-methylpyridine-2-carboxamide (PubChem CID 106012735) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 4-(3-cyclopentylpropylamino)-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3-cyclopentylpropylamino)-N-methylpyridine-2-carboxamide
PubChem CID106012735
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name4-(3-cyclopentylpropylamino)-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1cc(NCCCC2CCCC2)ccn1
InChIInChI=1S/C15H23N3O/c1-16-15(19)14-11-13(8-10-18-14)17-9-4-7-12-5-2-3-6-12/h8,10-12H,2-7,9H2,1H3,(H,16,19)(H,17,18)
InChIKeyGQEFALGXEBSIIX-UHFFFAOYSA-N
XLogP2.82
TPSA54.02 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 ≤ 52.82
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

4-[3-(cyclopropylamino)propylamino]-N-methylpyridine-2-carboxamide
CID 43599645
N-methyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide
CID 114516067
4-(2-cyclohexyloxyethylamino)-N-methylpyridine-2-carboxamide
CID 63828258
4-[(4-aminocyclohexyl)methylamino]-N-methylpyridine-2-carboxamide
CID 106129174
N-(cyclohexylmethyl)-4-(propylamino)pyridine-2-carboxamide
CID 62169677
N-cycloheptyl-4-[3-(dimethylamino)propylamino]pyridine-2-carboxamide
CID 109207939
N-methyl-4-[2-(4-methylpiperidin-1-yl)ethylamino]pyridine-2-carboxamide
CID 61241269
4-[(3-aminocyclobutyl)methylamino]-N-methylpyridine-2-carboxamide
CID 66006288
4-[[[2-(methylcarbamoyl)-4-pyridinyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 79526015
N-methyl-4-[2-(propylamino)ethylamino]pyridine-2-carboxamide
CID 62665007
4-(2-ethoxyethylamino)-N-methylpyridine-2-carboxamide
CID 43591225
N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide
CID 62171612

Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclopentylpropylamino)-N-methylpyridine-2-carboxamide?
The IUPAC name of 4-(3-cyclopentylpropylamino)-N-methylpyridine-2-carboxamide (CID 106012735) is 4-(3-cyclopentylpropylamino)-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 4-(3-cyclopentylpropylamino)-N-methylpyridine-2-carboxamide?
The canonical SMILES for 4-(3-cyclopentylpropylamino)-N-methylpyridine-2-carboxamide is CNC(=O)c1cc(NCCCC2CCCC2)ccn1.
What is the InChIKey of 4-(3-cyclopentylpropylamino)-N-methylpyridine-2-carboxamide?
The InChIKey is GQEFALGXEBSIIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-16-15(19)14-11-13(8-10-18-14)17-9-4-7-12-5-2-3-6-12/h8,10-12H,2-7,9H2,1H3,(H,16,19)(H,17,18).
What are the key properties of 4-(3-cyclopentylpropylamino)-N-methylpyridine-2-carboxamide?
4-(3-cyclopentylpropylamino)-N-methylpyridine-2-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.82, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclopentylpropylamino)-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 106012735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).