4-amino-3-benzoyl-1H-quinolin-2-one

C16H12N2O2 — CID 11737142

IUPAC4-amino-3-benzoyl-1H-quinolin-2-one
SMILESNc1c(C(=O)c2ccccc2)c(=O)[nH]c2ccccc12
InChIInChI=1S/C16H12N2O2/c17-14-11-8-4-5-9-12(11)18-16(20)13(14)15(19)10-6-2-1-3-7-10/h1-9H,(H3,17,18,20)
InChIKeyDZANZGCKLDSZFC-UHFFFAOYSA-N
MW264.28 g/mol
LogP2.34
Rot. Bonds2

About 4-amino-3-benzoyl-1H-quinolin-2-one

4-amino-3-benzoyl-1H-quinolin-2-one (PubChem CID 11737142) has the molecular formula C16H12N2O2 and a molecular weight of 264.28 g/mol. Its IUPAC name is 4-amino-3-benzoyl-1H-quinolin-2-one.

Molecular Properties

Compound Name4-amino-3-benzoyl-1H-quinolin-2-one
PubChem CID11737142
Molecular FormulaC16H12N2O2
Molecular Weight264.28 g/mol
Exact Mass264.09
IUPAC Name4-amino-3-benzoyl-1H-quinolin-2-one
SMILESNc1c(C(=O)c2ccccc2)c(=O)[nH]c2ccccc12
InChIInChI=1S/C16H12N2O2/c17-14-11-8-4-5-9-12(11)18-16(20)13(14)15(19)10-6-2-1-3-7-10/h1-9H,(H3,17,18,20)
InChIKeyDZANZGCKLDSZFC-UHFFFAOYSA-N
XLogP2.34
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-amino-3-benzoyl-1H-quinolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-benzoyl-1H-quinolin-2-one?
The IUPAC name of 4-amino-3-benzoyl-1H-quinolin-2-one (CID 11737142) is 4-amino-3-benzoyl-1H-quinolin-2-one.
What is the SMILES notation for 4-amino-3-benzoyl-1H-quinolin-2-one?
The canonical SMILES for 4-amino-3-benzoyl-1H-quinolin-2-one is Nc1c(C(=O)c2ccccc2)c(=O)[nH]c2ccccc12.
What is the InChIKey of 4-amino-3-benzoyl-1H-quinolin-2-one?
The InChIKey is DZANZGCKLDSZFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O2/c17-14-11-8-4-5-9-12(11)18-16(20)13(14)15(19)10-6-2-1-3-7-10/h1-9H,(H3,17,18,20).
What are the key properties of 4-amino-3-benzoyl-1H-quinolin-2-one?
4-amino-3-benzoyl-1H-quinolin-2-one has a molecular weight of 264.28 g/mol, XLogP of 2.34, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-benzoyl-1H-quinolin-2-one is sourced from PubChem (CID 11737142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).