N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide

C15H23N3O — CID 62168476

IUPACN-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ncccc1C(=O)NCC1CCCC1
InChIInChI=1S/C15H23N3O/c1-2-9-16-14-13(8-5-10-17-14)15(19)18-11-12-6-3-4-7-12/h5,8,10,12H,2-4,6-7,9,11H2,1H3,(H,16,17)(H,18,19)
InChIKeyLHWAFGLETZYVAZ-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.82
Rot. Bonds6

About N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide

N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide (PubChem CID 62168476) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide
PubChem CID62168476
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ncccc1C(=O)NCC1CCCC1
InChIInChI=1S/C15H23N3O/c1-2-9-16-14-13(8-5-10-17-14)15(19)18-11-12-6-3-4-7-12/h5,8,10,12H,2-4,6-7,9,11H2,1H3,(H,16,17)(H,18,19)
InChIKeyLHWAFGLETZYVAZ-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

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Related Compounds

N-(cyclohexylmethyl)-3-fluoro-2-(propylamino)pyridine-4-carboxamide
CID 105384839
N-[(1-ethylpyrrolidin-2-yl)methyl]-2-(propylamino)pyridine-3-carboxamide
CID 62165371
N-(3-propoxypropyl)-2-(propylamino)pyridine-3-carboxamide
CID 82946727
N-(cyclohexylmethyl)-2-ethylsulfanylpyridine-3-carboxamide
CID 142230892
N-(2-propan-2-yloxyethyl)-2-(propylamino)pyridine-3-carboxamide
CID 104765522
N-(2-methylsulfanylethyl)-2-(propylamino)pyridine-3-carboxamide
CID 63961240
N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide
CID 105068587
N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide
CID 63940110
2-(ethylamino)-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-3-carboxamide
CID 62181266
N-(2-cyclopentylethyl)-2-(methylamino)pyridine-3-carboxamide
CID 62180220
N-(2-phenylethyl)-2-(propylamino)pyridine-3-carboxamide
CID 62167056
N-(2-methyl-2-methylsulfonylpropyl)-2-(propylamino)pyridine-3-carboxamide
CID 79557910

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide (CID 62168476) is N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide is CCCNc1ncccc1C(=O)NCC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide?
The InChIKey is LHWAFGLETZYVAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-2-9-16-14-13(8-5-10-17-14)15(19)18-11-12-6-3-4-7-12/h5,8,10,12H,2-4,6-7,9,11H2,1H3,(H,16,17)(H,18,19).
What are the key properties of N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide?
N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-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 N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62168476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).