N-(1-butylpiperidin-4-yl)-2-oxo-1H-pyridine-4-carboxamide

C15H23N3O2 — CID 103763066

IUPACN-(1-butylpiperidin-4-yl)-2-oxo-1H-pyridine-4-carboxamide
SMILESCCCCN1CCC(NC(=O)c2cc[nH]c(=O)c2)CC1
InChIInChI=1S/C15H23N3O2/c1-2-3-8-18-9-5-13(6-10-18)17-15(20)12-4-7-16-14(19)11-12/h4,7,11,13H,2-3,5-6,8-10H2,1H3,(H,16,19)(H,17,20)
InChIKeyQPKLEUSKWMMKQY-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.37
Rot. Bonds5

About N-(1-butylpiperidin-4-yl)-2-oxo-1H-pyridine-4-carboxamide

N-(1-butylpiperidin-4-yl)-2-oxo-1H-pyridine-4-carboxamide (PubChem CID 103763066) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(1-butylpiperidin-4-yl)-2-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(1-butylpiperidin-4-yl)-2-oxo-1H-pyridine-4-carboxamide
PubChem CID103763066
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-(1-butylpiperidin-4-yl)-2-oxo-1H-pyridine-4-carboxamide
SMILESCCCCN1CCC(NC(=O)c2cc[nH]c(=O)c2)CC1
InChIInChI=1S/C15H23N3O2/c1-2-3-8-18-9-5-13(6-10-18)17-15(20)12-4-7-16-14(19)11-12/h4,7,11,13H,2-3,5-6,8-10H2,1H3,(H,16,19)(H,17,20)
InChIKeyQPKLEUSKWMMKQY-UHFFFAOYSA-N
XLogP1.37
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 47363948
N-(1-ethylpiperidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide
CID 103765277
N-(1-butylpiperidin-4-yl)-4-(chloromethyl)benzamide
CID 43696349
N-[2-(4-methylpiperidin-1-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103764080
3-methyl-N-(1-propylpiperidin-4-yl)benzamide
CID 17249825
3-hydroxy-N-(1-propylpiperidin-4-yl)benzamide
CID 60664742
N-(1-methyl-2-oxopyrrolidin-3-yl)-2-oxo-1H-pyridine-4-carboxamide
CID 113257175
4-hydroxy-3-methyl-N-(1-propylpiperidin-4-yl)benzamide
CID 103951674
N-(1-butylpiperidin-4-yl)acetamide
CID 21136025
4-bromo-N-(1-butylpiperidin-4-yl)-1-methylpyrrole-2-carboxamide
CID 60956390
N-(3,4-dimethylcyclohexyl)-2-oxo-1H-pyridine-4-carboxamide
CID 104578730
N-(1-propylpiperidin-4-yl)pyridine-4-carboxamide
CID 17249951

Frequently Asked Questions

What is the IUPAC name of N-(1-butylpiperidin-4-yl)-2-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of N-(1-butylpiperidin-4-yl)-2-oxo-1H-pyridine-4-carboxamide (CID 103763066) is N-(1-butylpiperidin-4-yl)-2-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for N-(1-butylpiperidin-4-yl)-2-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for N-(1-butylpiperidin-4-yl)-2-oxo-1H-pyridine-4-carboxamide is CCCCN1CCC(NC(=O)c2cc[nH]c(=O)c2)CC1.
What is the InChIKey of N-(1-butylpiperidin-4-yl)-2-oxo-1H-pyridine-4-carboxamide?
The InChIKey is QPKLEUSKWMMKQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-2-3-8-18-9-5-13(6-10-18)17-15(20)12-4-7-16-14(19)11-12/h4,7,11,13H,2-3,5-6,8-10H2,1H3,(H,16,19)(H,17,20).
What are the key properties of N-(1-butylpiperidin-4-yl)-2-oxo-1H-pyridine-4-carboxamide?
N-(1-butylpiperidin-4-yl)-2-oxo-1H-pyridine-4-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 1.37, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-butylpiperidin-4-yl)-2-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 103763066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).