N-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide

C15H23N3O — CID 46384683

IUPACN-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide
SMILESCCC(C)NC(=O)C1CCN(c2ccncc2)CC1
InChIInChI=1S/C15H23N3O/c1-3-12(2)17-15(19)13-6-10-18(11-7-13)14-4-8-16-9-5-14/h4-5,8-9,12-13H,3,6-7,10-11H2,1-2H3,(H,17,19)
InChIKeyMMFZLGSVXJFEPL-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.21
Rot. Bonds4

About N-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide

N-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide (PubChem CID 46384683) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide
PubChem CID46384683
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide
SMILESCCC(C)NC(=O)C1CCN(c2ccncc2)CC1
InChIInChI=1S/C15H23N3O/c1-3-12(2)17-15(19)13-6-10-18(11-7-13)14-4-8-16-9-5-14/h4-5,8-9,12-13H,3,6-7,10-11H2,1-2H3,(H,17,19)
InChIKeyMMFZLGSVXJFEPL-UHFFFAOYSA-N
XLogP2.21
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(dimethylamino)-1-oxopropan-2-yl]-1-pyridin-4-ylpiperidine-4-carboxamide
CID 174493993
N-butan-2-yl-1-pyrido[2,3-b]pyrazin-7-ylpiperidine-4-carboxamide
CID 71839302
1-(1-pyridin-4-ylpiperidin-4-yl)propan-1-ol
CID 18918443
N-[3-oxo-3-piperidin-1-yl-2-(propanoylamino)propyl]-1-pyridin-4-ylpiperidine-4-carboxamide
CID 67620952
N-(3-ethylphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide
CID 46384741
N-(2-ethyl-6-methylphenyl)-1-pyridin-4-ylpiperidine-4-carboxamide
CID 46384738
N-butan-2-yl-1-(pyridine-3-carbonyl)piperidine-4-carboxamide
CID 113002848
N-butan-2-yl-1-[2-(4-methylphenyl)pyrimidin-4-yl]piperidine-4-carboxamide
CID 53006937
N-[3-(2-ethylpiperidin-1-yl)propyl]-1-pyridin-4-ylpiperidine-4-carboxamide
CID 46384777
N'-propan-2-yl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]oxamide
CID 121107650
N-butan-2-yl-1-[6-(3-methylphenyl)pyridazin-3-yl]piperidine-4-carboxamide
CID 53025183
N-butan-2-yl-1-[4-(4-methylpiperazin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide
CID 53165875

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide?
The IUPAC name of N-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide (CID 46384683) is N-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide?
The canonical SMILES for N-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide is CCC(C)NC(=O)C1CCN(c2ccncc2)CC1.
What is the InChIKey of N-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide?
The InChIKey is MMFZLGSVXJFEPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-12(2)17-15(19)13-6-10-18(11-7-13)14-4-8-16-9-5-14/h4-5,8-9,12-13H,3,6-7,10-11H2,1-2H3,(H,17,19).
What are the key properties of N-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide?
N-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide is sourced from PubChem (CID 46384683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).