2-oxo-N-(2-propylpentyl)-1H-pyridine-4-carboxamide

C14H22N2O2 — CID 143746540

IUPAC2-oxo-N-(2-propylpentyl)-1H-pyridine-4-carboxamide
SMILESCCCC(CCC)CNC(=O)c1cc[nH]c(=O)c1
InChIInChI=1S/C14H22N2O2/c1-3-5-11(6-4-2)10-16-14(18)12-7-8-15-13(17)9-12/h7-9,11H,3-6,10H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyOHSZPKIQADDSFF-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.32
Rot. Bonds7

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

2-oxo-N-(2-propylpentyl)-1H-pyridine-4-carboxamide (PubChem CID 143746540) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-oxo-N-(2-propylpentyl)-1H-pyridine-4-carboxamide.

Molecular Properties

Compound Name2-oxo-N-(2-propylpentyl)-1H-pyridine-4-carboxamide
PubChem CID143746540
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-oxo-N-(2-propylpentyl)-1H-pyridine-4-carboxamide
SMILESCCCC(CCC)CNC(=O)c1cc[nH]c(=O)c1
InChIInChI=1S/C14H22N2O2/c1-3-5-11(6-4-2)10-16-14(18)12-7-8-15-13(17)9-12/h7-9,11H,3-6,10H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyOHSZPKIQADDSFF-UHFFFAOYSA-N
XLogP2.32
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-(2-propylpentyl)-1H-pyridine-4-carboxamide?
The IUPAC name of 2-oxo-N-(2-propylpentyl)-1H-pyridine-4-carboxamide (CID 143746540) is 2-oxo-N-(2-propylpentyl)-1H-pyridine-4-carboxamide.
What is the SMILES notation for 2-oxo-N-(2-propylpentyl)-1H-pyridine-4-carboxamide?
The canonical SMILES for 2-oxo-N-(2-propylpentyl)-1H-pyridine-4-carboxamide is CCCC(CCC)CNC(=O)c1cc[nH]c(=O)c1.
What is the InChIKey of 2-oxo-N-(2-propylpentyl)-1H-pyridine-4-carboxamide?
The InChIKey is OHSZPKIQADDSFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-3-5-11(6-4-2)10-16-14(18)12-7-8-15-13(17)9-12/h7-9,11H,3-6,10H2,1-2H3,(H,15,17)(H,16,18).
What are the key properties of 2-oxo-N-(2-propylpentyl)-1H-pyridine-4-carboxamide?
2-oxo-N-(2-propylpentyl)-1H-pyridine-4-carboxamide has a molecular weight of 250.34 g/mol, XLogP of 2.32, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-(2-propylpentyl)-1H-pyridine-4-carboxamide is sourced from PubChem (CID 143746540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).