8-bromo-7-methoxy-1H-quinolin-2-one

C10H8BrNO2 — CID 169499503

IUPAC8-bromo-7-methoxy-1H-quinolin-2-one
SMILESCOc1ccc2ccc(=O)[nH]c2c1Br
InChIInChI=1S/C10H8BrNO2/c1-14-7-4-2-6-3-5-8(13)12-10(6)9(7)11/h2-5H,1H3,(H,12,13)
InChIKeyTZONLLZZHFAZQG-UHFFFAOYSA-N
MW254.08 g/mol
LogP2.30
Rot. Bonds1

About 8-bromo-7-methoxy-1H-quinolin-2-one

8-bromo-7-methoxy-1H-quinolin-2-one (PubChem CID 169499503) has the molecular formula C10H8BrNO2 and a molecular weight of 254.08 g/mol. Its IUPAC name is 8-bromo-7-methoxy-1H-quinolin-2-one.

Molecular Properties

Compound Name8-bromo-7-methoxy-1H-quinolin-2-one
PubChem CID169499503
Molecular FormulaC10H8BrNO2
Molecular Weight254.08 g/mol
Exact Mass252.97
IUPAC Name8-bromo-7-methoxy-1H-quinolin-2-one
SMILESCOc1ccc2ccc(=O)[nH]c2c1Br
InChIInChI=1S/C10H8BrNO2/c1-14-7-4-2-6-3-5-8(13)12-10(6)9(7)11/h2-5H,1H3,(H,12,13)
InChIKeyTZONLLZZHFAZQG-UHFFFAOYSA-N
XLogP2.30
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.08
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 8-bromo-7-methoxy-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 8-bromo-7-methoxy-1H-quinolin-2-one?
The IUPAC name of 8-bromo-7-methoxy-1H-quinolin-2-one (CID 169499503) is 8-bromo-7-methoxy-1H-quinolin-2-one.
What is the SMILES notation for 8-bromo-7-methoxy-1H-quinolin-2-one?
The canonical SMILES for 8-bromo-7-methoxy-1H-quinolin-2-one is COc1ccc2ccc(=O)[nH]c2c1Br.
What is the InChIKey of 8-bromo-7-methoxy-1H-quinolin-2-one?
The InChIKey is TZONLLZZHFAZQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrNO2/c1-14-7-4-2-6-3-5-8(13)12-10(6)9(7)11/h2-5H,1H3,(H,12,13).
What are the key properties of 8-bromo-7-methoxy-1H-quinolin-2-one?
8-bromo-7-methoxy-1H-quinolin-2-one has a molecular weight of 254.08 g/mol, XLogP of 2.30, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-7-methoxy-1H-quinolin-2-one is sourced from PubChem (CID 169499503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).