N-(3-acetyl-2-oxoquinolin-1-yl)-2-hydroxybenzamide

C18H14N2O4 — CID 166442160

IUPACN-(3-acetyl-2-oxoquinolin-1-yl)-2-hydroxybenzamide
SMILESCC(=O)c1cc2ccccc2n(NC(=O)c2ccccc2O)c1=O
InChIInChI=1S/C18H14N2O4/c1-11(21)14-10-12-6-2-4-8-15(12)20(18(14)24)19-17(23)13-7-3-5-9-16(13)22/h2-10,22H,1H3,(H,19,23)
InChIKeyVBPGWZHILNPWLN-UHFFFAOYSA-N
MW322.32 g/mol
LogP2.29
Rot. Bonds3

About N-(3-acetyl-2-oxoquinolin-1-yl)-2-hydroxybenzamide

N-(3-acetyl-2-oxoquinolin-1-yl)-2-hydroxybenzamide (PubChem CID 166442160) has the molecular formula C18H14N2O4 and a molecular weight of 322.32 g/mol. Its IUPAC name is N-(3-acetyl-2-oxoquinolin-1-yl)-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(3-acetyl-2-oxoquinolin-1-yl)-2-hydroxybenzamide
PubChem CID166442160
Molecular FormulaC18H14N2O4
Molecular Weight322.32 g/mol
Exact Mass322.10
IUPAC NameN-(3-acetyl-2-oxoquinolin-1-yl)-2-hydroxybenzamide
SMILESCC(=O)c1cc2ccccc2n(NC(=O)c2ccccc2O)c1=O
InChIInChI=1S/C18H14N2O4/c1-11(21)14-10-12-6-2-4-8-15(12)20(18(14)24)19-17(23)13-7-3-5-9-16(13)22/h2-10,22H,1H3,(H,19,23)
InChIKeyVBPGWZHILNPWLN-UHFFFAOYSA-N
XLogP2.29
TPSA88.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.32
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-acetyl-2-oxoquinolin-1-yl)-2-hydroxybenzamide?
The IUPAC name of N-(3-acetyl-2-oxoquinolin-1-yl)-2-hydroxybenzamide (CID 166442160) is N-(3-acetyl-2-oxoquinolin-1-yl)-2-hydroxybenzamide.
What is the SMILES notation for N-(3-acetyl-2-oxoquinolin-1-yl)-2-hydroxybenzamide?
The canonical SMILES for N-(3-acetyl-2-oxoquinolin-1-yl)-2-hydroxybenzamide is CC(=O)c1cc2ccccc2n(NC(=O)c2ccccc2O)c1=O.
What is the InChIKey of N-(3-acetyl-2-oxoquinolin-1-yl)-2-hydroxybenzamide?
The InChIKey is VBPGWZHILNPWLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O4/c1-11(21)14-10-12-6-2-4-8-15(12)20(18(14)24)19-17(23)13-7-3-5-9-16(13)22/h2-10,22H,1H3,(H,19,23).
What are the key properties of N-(3-acetyl-2-oxoquinolin-1-yl)-2-hydroxybenzamide?
N-(3-acetyl-2-oxoquinolin-1-yl)-2-hydroxybenzamide has a molecular weight of 322.32 g/mol, XLogP of 2.29, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetyl-2-oxoquinolin-1-yl)-2-hydroxybenzamide is sourced from PubChem (CID 166442160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).