N-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide

C15H23N3O2 — CID 47363948

IUPACN-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCCCCN1CCC(NC(=O)c2ccc(=O)[nH]c2)CC1
InChIInChI=1S/C15H23N3O2/c1-2-3-8-18-9-6-13(7-10-18)17-15(20)12-4-5-14(19)16-11-12/h4-5,11,13H,2-3,6-10H2,1H3,(H,16,19)(H,17,20)
InChIKeyHRFCVWGYOBOJEP-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.37
Rot. Bonds5

About N-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide

N-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 47363948) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide
PubChem CID47363948
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCCCCN1CCC(NC(=O)c2ccc(=O)[nH]c2)CC1
InChIInChI=1S/C15H23N3O2/c1-2-3-8-18-9-6-13(7-10-18)17-15(20)12-4-5-14(19)16-11-12/h4-5,11,13H,2-3,6-10H2,1H3,(H,16,19)(H,17,20)
InChIKeyHRFCVWGYOBOJEP-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)-2-oxo-1H-pyridine-4-carboxamide
CID 103763066
N-[3-(4-methylpiperidin-1-yl)propyl]-6-oxo-1H-pyridine-3-carboxamide
CID 30541274
N-(1-butylpiperidin-4-yl)-4-(chloromethyl)benzamide
CID 43696349
N-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 64668240
4-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 60808216
4-(4-hydroxypiperidin-1-yl)-N-(1-propylpiperidin-4-yl)benzamide
CID 111331639
N-[1-(3-chloropropyl)piperidin-4-yl]-4-methylbenzamide
CID 54204989
N-(1-butylpiperidin-4-yl)acetamide
CID 21136025
N-(1-propylpiperidin-4-yl)pyridine-4-carboxamide
CID 17249951
N-(oxan-3-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 63361586
N-[1-(6-oxo-1H-pyridine-3-carbonyl)piperidin-4-yl]acetamide
CID 49348738
4-hydroxy-3-methyl-N-(1-propylpiperidin-4-yl)benzamide
CID 103951674

Frequently Asked Questions

What is the IUPAC name of N-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide (CID 47363948) is N-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide is CCCCN1CCC(NC(=O)c2ccc(=O)[nH]c2)CC1.
What is the InChIKey of N-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is HRFCVWGYOBOJEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-2-3-8-18-9-6-13(7-10-18)17-15(20)12-4-5-14(19)16-11-12/h4-5,11,13H,2-3,6-10H2,1H3,(H,16,19)(H,17,20).
What are the key properties of N-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide?
N-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-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)-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 47363948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).