N,N-dibutyl-2-oxo-1H-pyridine-3-carboxamide

C14H22N2O2 — CID 20518087

IUPACN,N-dibutyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCCCN(CCCC)C(=O)c1ccc[nH]c1=O
InChIInChI=1S/C14H22N2O2/c1-3-5-10-16(11-6-4-2)14(18)12-8-7-9-15-13(12)17/h7-9H,3-6,10-11H2,1-2H3,(H,15,17)
InChIKeyOMGVIAHGJNIXGG-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.42
Rot. Bonds7

About N,N-dibutyl-2-oxo-1H-pyridine-3-carboxamide

N,N-dibutyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 20518087) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N,N-dibutyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN,N-dibutyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID20518087
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC NameN,N-dibutyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCCCN(CCCC)C(=O)c1ccc[nH]c1=O
InChIInChI=1S/C14H22N2O2/c1-3-5-10-16(11-6-4-2)14(18)12-8-7-9-15-13(12)17/h7-9H,3-6,10-11H2,1-2H3,(H,15,17)
InChIKeyOMGVIAHGJNIXGG-UHFFFAOYSA-N
XLogP2.42
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dibutyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N,N-dibutyl-2-oxo-1H-pyridine-3-carboxamide (CID 20518087) is N,N-dibutyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N,N-dibutyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N,N-dibutyl-2-oxo-1H-pyridine-3-carboxamide is CCCCN(CCCC)C(=O)c1ccc[nH]c1=O.
What is the InChIKey of N,N-dibutyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is OMGVIAHGJNIXGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-3-5-10-16(11-6-4-2)14(18)12-8-7-9-15-13(12)17/h7-9H,3-6,10-11H2,1-2H3,(H,15,17).
What are the key properties of N,N-dibutyl-2-oxo-1H-pyridine-3-carboxamide?
N,N-dibutyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 250.34 g/mol, XLogP of 2.42, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 20518087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).