1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide

C13H17N3O2 — CID 110696934

IUPAC1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)Cc2ccccn2)CC1
InChIInChI=1S/C13H17N3O2/c14-13(18)10-4-7-16(8-5-10)12(17)9-11-3-1-2-6-15-11/h1-3,6,10H,4-5,7-9H2,(H2,14,18)
InChIKeyXFYYFCLTXIXYDX-UHFFFAOYSA-N
MW247.30 g/mol
LogP0.35
Rot. Bonds3

About 1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide

1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide (PubChem CID 110696934) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is 1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide
PubChem CID110696934
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC Name1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)Cc2ccccn2)CC1
InChIInChI=1S/C13H17N3O2/c14-13(18)10-4-7-16(8-5-10)12(17)9-11-3-1-2-6-15-11/h1-3,6,10H,4-5,7-9H2,(H2,14,18)
InChIKeyXFYYFCLTXIXYDX-UHFFFAOYSA-N
XLogP0.35
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-oxo-4-(pyridin-2-ylmethylamino)butanoyl]piperidine-4-carboxamide
CID 3485288
1-[2-(5-amino-2-pyridinyl)acetyl]piperidine-4-carboxamide
CID 107337428
1-[4-[hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-2-pyridin-2-ylethanone
CID 77091494
1-(3,4-dihydroxypyrrolidin-1-yl)-2-pyridin-2-ylethanone
CID 106671158
2-pyridin-2-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
CID 110696951
1-(3-methylpiperidin-1-yl)-2-pyridin-2-ylethanone
CID 110696959
1-(3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridin-2-ylethanone
CID 112534802
2-phenyl-5-[4-(2-pyridin-2-ylacetyl)piperazine-1-carbonyl]-3,4-dihydropyrazole-3-carboxamide
CID 56521146
1-(3-amino-5-methylpiperidin-1-yl)-2-pyridin-2-ylethanone
CID 79993365
1-[4-[(1R)-2,2-dichlorocyclopropanecarbonyl]piperazin-1-yl]-2-pyridin-2-ylethanone
CID 95769741
1-(8,8-difluoro-3-azabicyclo[3.2.1]octan-3-yl)-2-pyridin-2-ylethanone
CID 131687605
1-(3-hydroxy-4,4-dimethylpiperidin-1-yl)-2-pyridin-2-ylethanone
CID 115276738

Frequently Asked Questions

What is the IUPAC name of 1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide (CID 110696934) is 1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)Cc2ccccn2)CC1.
What is the InChIKey of 1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide?
The InChIKey is XFYYFCLTXIXYDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c14-13(18)10-4-7-16(8-5-10)12(17)9-11-3-1-2-6-15-11/h1-3,6,10H,4-5,7-9H2,(H2,14,18).
What are the key properties of 1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide?
1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide has a molecular weight of 247.30 g/mol, XLogP of 0.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide is sourced from PubChem (CID 110696934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).