N-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide

C15H22N4O — CID 47050086

IUPACN-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide
SMILESO=C(Nc1cccnc1)N1CCCC(N2CCCC2)C1
InChIInChI=1S/C15H22N4O/c20-15(17-13-5-3-7-16-11-13)19-10-4-6-14(12-19)18-8-1-2-9-18/h3,5,7,11,14H,1-2,4,6,8-10,12H2,(H,17,20)
InChIKeyJKSRHXWNJFDLDW-UHFFFAOYSA-N
MW274.37 g/mol
LogP2.17
Rot. Bonds2

About N-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide

N-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide (PubChem CID 47050086) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is N-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide
PubChem CID47050086
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC NameN-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide
SMILESO=C(Nc1cccnc1)N1CCCC(N2CCCC2)C1
InChIInChI=1S/C15H22N4O/c20-15(17-13-5-3-7-16-11-13)19-10-4-6-14(12-19)18-8-1-2-9-18/h3,5,7,11,14H,1-2,4,6,8-10,12H2,(H,17,20)
InChIKeyJKSRHXWNJFDLDW-UHFFFAOYSA-N
XLogP2.17
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-N-[4-(pyridin-4-ylmethyl)phenyl]-3-pyrrolidin-1-ylpiperidine-1-carboxamide
CID 52518441
(9aS)-N-(6-chloro-3-pyridinyl)-1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepine-2-carboxamide
CID 118789483
methyl N-[4-[[(3S)-3-pyrrolidin-1-ylpiperidine-1-carbonyl]amino]phenyl]carbamate
CID 99808497
N-phenyl-3-pyrrolidin-1-ylazetidine-1-carboxamide
CID 23140407
N-[3-(pyrazol-1-ylmethyl)phenyl]-3-pyrrolidin-1-ylpiperidine-1-carboxamide
CID 56796288
N-(3,4-difluorophenyl)-3-pyrrolidin-1-ylpiperidine-1-carboxamide
CID 146121673
4-[cyclobutyl(methylsulfonyl)amino]-N-pyridin-3-ylazepane-1-carboxamide
CID 129004395
(3R)-N-(3-cyclopentylsulfonylphenyl)-3-pyrrolidin-1-ylpiperidine-1-carboxamide
CID 52518848
4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide
CID 3370606
1-[1-(pyridin-3-ylcarbamoyl)azetidin-3-yl]triazole-4-carboxylic acid
CID 79311465
1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl-(4-chloro-3-pyridinyl)methanone
CID 81226844
(3R)-3-(4-methoxyphenyl)-N-pyridin-3-ylpyrrolidine-1-carboxamide
CID 94824028

Frequently Asked Questions

What is the IUPAC name of N-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide?
The IUPAC name of N-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide (CID 47050086) is N-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide.
What is the SMILES notation for N-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide?
The canonical SMILES for N-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide is O=C(Nc1cccnc1)N1CCCC(N2CCCC2)C1.
What is the InChIKey of N-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide?
The InChIKey is JKSRHXWNJFDLDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c20-15(17-13-5-3-7-16-11-13)19-10-4-6-14(12-19)18-8-1-2-9-18/h3,5,7,11,14H,1-2,4,6,8-10,12H2,(H,17,20).
What are the key properties of N-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide?
N-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide has a molecular weight of 274.37 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-3-yl-3-pyrrolidin-1-ylpiperidine-1-carboxamide is sourced from PubChem (CID 47050086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).