7-bromo-3-hydroxy-1H-quinolin-2-one

C9H6BrNO2 — CID 71742450

IUPAC7-bromo-3-hydroxy-1H-quinolin-2-one
SMILESO=c1[nH]c2cc(Br)ccc2cc1O
InChIInChI=1S/C9H6BrNO2/c10-6-2-1-5-3-8(12)9(13)11-7(5)4-6/h1-4,12H,(H,11,13)
InChIKeyGQIJNKFEPOJJJI-UHFFFAOYSA-N
MW240.06 g/mol
LogP2.00
Rot. Bonds

About 7-bromo-3-hydroxy-1H-quinolin-2-one

7-bromo-3-hydroxy-1H-quinolin-2-one (PubChem CID 71742450) has the molecular formula C9H6BrNO2 and a molecular weight of 240.06 g/mol. Its IUPAC name is 7-bromo-3-hydroxy-1H-quinolin-2-one.

Molecular Properties

Compound Name7-bromo-3-hydroxy-1H-quinolin-2-one
PubChem CID71742450
Molecular FormulaC9H6BrNO2
Molecular Weight240.06 g/mol
Exact Mass238.96
IUPAC Name7-bromo-3-hydroxy-1H-quinolin-2-one
SMILESO=c1[nH]c2cc(Br)ccc2cc1O
InChIInChI=1S/C9H6BrNO2/c10-6-2-1-5-3-8(12)9(13)11-7(5)4-6/h1-4,12H,(H,11,13)
InChIKeyGQIJNKFEPOJJJI-UHFFFAOYSA-N
XLogP2.00
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.06
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-3-hydroxy-1H-quinolin-2-one?
The IUPAC name of 7-bromo-3-hydroxy-1H-quinolin-2-one (CID 71742450) is 7-bromo-3-hydroxy-1H-quinolin-2-one.
What is the SMILES notation for 7-bromo-3-hydroxy-1H-quinolin-2-one?
The canonical SMILES for 7-bromo-3-hydroxy-1H-quinolin-2-one is O=c1[nH]c2cc(Br)ccc2cc1O.
What is the InChIKey of 7-bromo-3-hydroxy-1H-quinolin-2-one?
The InChIKey is GQIJNKFEPOJJJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6BrNO2/c10-6-2-1-5-3-8(12)9(13)11-7(5)4-6/h1-4,12H,(H,11,13).
What are the key properties of 7-bromo-3-hydroxy-1H-quinolin-2-one?
7-bromo-3-hydroxy-1H-quinolin-2-one has a molecular weight of 240.06 g/mol, XLogP of 2.00, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-3-hydroxy-1H-quinolin-2-one is sourced from PubChem (CID 71742450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).