6-bromo-4-hydroxy-1H-quinolin-2-one

C9H6BrNO2 — CID 54689446

IUPAC6-bromo-4-hydroxy-1H-quinolin-2-one
SMILESO=c1cc(O)c2cc(Br)ccc2[nH]1
InChIInChI=1S/C9H6BrNO2/c10-5-1-2-7-6(3-5)8(12)4-9(13)11-7/h1-4H,(H2,11,12,13)
InChIKeyDQFPMEMMMGZBKU-UHFFFAOYSA-N
MW240.06 g/mol
LogP2.00
Rot. Bonds

About 6-bromo-4-hydroxy-1H-quinolin-2-one

6-bromo-4-hydroxy-1H-quinolin-2-one (PubChem CID 54689446) has the molecular formula C9H6BrNO2 and a molecular weight of 240.06 g/mol. Its IUPAC name is 6-bromo-4-hydroxy-1H-quinolin-2-one.

Molecular Properties

Compound Name6-bromo-4-hydroxy-1H-quinolin-2-one
PubChem CID54689446
Molecular FormulaC9H6BrNO2
Molecular Weight240.06 g/mol
Exact Mass238.96
IUPAC Name6-bromo-4-hydroxy-1H-quinolin-2-one
SMILESO=c1cc(O)c2cc(Br)ccc2[nH]1
InChIInChI=1S/C9H6BrNO2/c10-5-1-2-7-6(3-5)8(12)4-9(13)11-7/h1-4H,(H2,11,12,13)
InChIKeyDQFPMEMMMGZBKU-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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Related Compounds

2,4-Dihydroxyquinoline
CID 54680871
4-Hydroxy-2-oxo-1,2-dihydroquinoline-3-carbonitrile
CID 54694513
4-Hydroxy-3-methylquinolin-2(1H)-one
CID 54678416
8-bromo-5-hydroxy-1H-1-benzazepine-2,3-dione
CID 10400801
2,3,4-Quinolinetriol
CID 54677846
6-Bromo-2-hydroxyquinoline-4-carboxylic acid
CID 228464
2-Acetamido-5-bromobenzoic Acid
CID 520935
6-Bromoquinolin-2(1H)-one
CID 12378943
5-Bromo-2-(pentanoylamino)benzoic acid
CID 2282660
2(1H)-Quinolinone, 3-fluoro-4-hydroxy-
CID 54686281
4-Hydroxy-3-propylquinolin-2(1H)-one
CID 54680429
3-Butyl-4-hydroxy-1H-quinolin-2-one
CID 54684097

Frequently Asked Questions

What is the IUPAC name of 6-bromo-4-hydroxy-1H-quinolin-2-one?
The IUPAC name of 6-bromo-4-hydroxy-1H-quinolin-2-one (CID 54689446) is 6-bromo-4-hydroxy-1H-quinolin-2-one.
What is the SMILES notation for 6-bromo-4-hydroxy-1H-quinolin-2-one?
The canonical SMILES for 6-bromo-4-hydroxy-1H-quinolin-2-one is O=c1cc(O)c2cc(Br)ccc2[nH]1.
What is the InChIKey of 6-bromo-4-hydroxy-1H-quinolin-2-one?
The InChIKey is DQFPMEMMMGZBKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6BrNO2/c10-5-1-2-7-6(3-5)8(12)4-9(13)11-7/h1-4H,(H2,11,12,13).
What are the key properties of 6-bromo-4-hydroxy-1H-quinolin-2-one?
6-bromo-4-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 6-bromo-4-hydroxy-1H-quinolin-2-one is sourced from PubChem (CID 54689446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).