1-cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2-one

C18H19NO3 — CID 74983125

IUPAC1-cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2-one
SMILESO=C(c1ccc(=O)n(C2CCCCC2)c1)c1ccccc1O
InChIInChI=1S/C18H19NO3/c20-16-9-5-4-8-15(16)18(22)13-10-11-17(21)19(12-13)14-6-2-1-3-7-14/h4-5,8-12,14,20H,1-3,6-7H2
InChIKeyLMWXCDJSKNGXJM-UHFFFAOYSA-N
MW297.35 g/mol
LogP3.29
Rot. Bonds3

About 1-cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2-one

1-cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2-one (PubChem CID 74983125) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is 1-cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2-one.

Molecular Properties

Compound Name1-cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2-one
PubChem CID74983125
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC Name1-cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2-one
SMILESO=C(c1ccc(=O)n(C2CCCCC2)c1)c1ccccc1O
InChIInChI=1S/C18H19NO3/c20-16-9-5-4-8-15(16)18(22)13-10-11-17(21)19(12-13)14-6-2-1-3-7-14/h4-5,8-12,14,20H,1-3,6-7H2
InChIKeyLMWXCDJSKNGXJM-UHFFFAOYSA-N
XLogP3.29
TPSA59.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2-one?
The IUPAC name of 1-cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2-one (CID 74983125) is 1-cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2-one.
What is the SMILES notation for 1-cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2-one?
The canonical SMILES for 1-cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2-one is O=C(c1ccc(=O)n(C2CCCCC2)c1)c1ccccc1O.
What is the InChIKey of 1-cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2-one?
The InChIKey is LMWXCDJSKNGXJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c20-16-9-5-4-8-15(16)18(22)13-10-11-17(21)19(12-13)14-6-2-1-3-7-14/h4-5,8-12,14,20H,1-3,6-7H2.
What are the key properties of 1-cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2-one?
1-cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2-one has a molecular weight of 297.35 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2-one is sourced from PubChem (CID 74983125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).