2-(cyclohexen-1-yl)-4-(2-oxo-1H-pyridin-4-yl)benzamide

C18H18N2O2 — CID 68838552

IUPAC2-(cyclohexen-1-yl)-4-(2-oxo-1H-pyridin-4-yl)benzamide
SMILESNC(=O)c1ccc(-c2cc[nH]c(=O)c2)cc1C1=CCCCC1
InChIInChI=1S/C18H18N2O2/c19-18(22)15-7-6-13(14-8-9-20-17(21)11-14)10-16(15)12-4-2-1-3-5-12/h4,6-11H,1-3,5H2,(H2,19,22)(H,20,21)
InChIKeyGQWDYAARFMIFRI-UHFFFAOYSA-N
MW294.35 g/mol
LogP3.10
Rot. Bonds3

About 2-(cyclohexen-1-yl)-4-(2-oxo-1H-pyridin-4-yl)benzamide

2-(cyclohexen-1-yl)-4-(2-oxo-1H-pyridin-4-yl)benzamide (PubChem CID 68838552) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is 2-(cyclohexen-1-yl)-4-(2-oxo-1H-pyridin-4-yl)benzamide.

Molecular Properties

Compound Name2-(cyclohexen-1-yl)-4-(2-oxo-1H-pyridin-4-yl)benzamide
PubChem CID68838552
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC Name2-(cyclohexen-1-yl)-4-(2-oxo-1H-pyridin-4-yl)benzamide
SMILESNC(=O)c1ccc(-c2cc[nH]c(=O)c2)cc1C1=CCCCC1
InChIInChI=1S/C18H18N2O2/c19-18(22)15-7-6-13(14-8-9-20-17(21)11-14)10-16(15)12-4-2-1-3-5-12/h4,6-11H,1-3,5H2,(H2,19,22)(H,20,21)
InChIKeyGQWDYAARFMIFRI-UHFFFAOYSA-N
XLogP3.10
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexen-1-yl)-4-(2-oxo-1H-pyridin-4-yl)benzamide?
The IUPAC name of 2-(cyclohexen-1-yl)-4-(2-oxo-1H-pyridin-4-yl)benzamide (CID 68838552) is 2-(cyclohexen-1-yl)-4-(2-oxo-1H-pyridin-4-yl)benzamide.
What is the SMILES notation for 2-(cyclohexen-1-yl)-4-(2-oxo-1H-pyridin-4-yl)benzamide?
The canonical SMILES for 2-(cyclohexen-1-yl)-4-(2-oxo-1H-pyridin-4-yl)benzamide is NC(=O)c1ccc(-c2cc[nH]c(=O)c2)cc1C1=CCCCC1.
What is the InChIKey of 2-(cyclohexen-1-yl)-4-(2-oxo-1H-pyridin-4-yl)benzamide?
The InChIKey is GQWDYAARFMIFRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c19-18(22)15-7-6-13(14-8-9-20-17(21)11-14)10-16(15)12-4-2-1-3-5-12/h4,6-11H,1-3,5H2,(H2,19,22)(H,20,21).
What are the key properties of 2-(cyclohexen-1-yl)-4-(2-oxo-1H-pyridin-4-yl)benzamide?
2-(cyclohexen-1-yl)-4-(2-oxo-1H-pyridin-4-yl)benzamide has a molecular weight of 294.35 g/mol, XLogP of 3.10, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexen-1-yl)-4-(2-oxo-1H-pyridin-4-yl)benzamide is sourced from PubChem (CID 68838552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).