7-bromo-2-fluoroquinolin-8-ol

C9H5BrFNO — CID 141280173

IUPAC7-bromo-2-fluoroquinolin-8-ol
SMILESOc1c(Br)ccc2ccc(F)nc12
InChIInChI=1S/C9H5BrFNO/c10-6-3-1-5-2-4-7(11)12-8(5)9(6)13/h1-4,13H
InChIKeyIHHZSLOIUWREPP-UHFFFAOYSA-N
MW242.05 g/mol
LogP2.84
Rot. Bonds

About 7-bromo-2-fluoroquinolin-8-ol

7-bromo-2-fluoroquinolin-8-ol (PubChem CID 141280173) has the molecular formula C9H5BrFNO and a molecular weight of 242.05 g/mol. Its IUPAC name is 7-bromo-2-fluoroquinolin-8-ol.

Molecular Properties

Compound Name7-bromo-2-fluoroquinolin-8-ol
PubChem CID141280173
Molecular FormulaC9H5BrFNO
Molecular Weight242.05 g/mol
Exact Mass240.95
IUPAC Name7-bromo-2-fluoroquinolin-8-ol
SMILESOc1c(Br)ccc2ccc(F)nc12
InChIInChI=1S/C9H5BrFNO/c10-6-3-1-5-2-4-7(11)12-8(5)9(6)13/h1-4,13H
InChIKeyIHHZSLOIUWREPP-UHFFFAOYSA-N
XLogP2.84
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.05
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

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CID 58555940
7-bromo-2-chloroquinazolin-8-ol
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CID 86767805
(3-bromo-6-fluoro-2-pyridinyl)methanamine
CID 104546703
3-bromo-6-fluoropyridine-2-carbonitrile
CID 84669802
2-bromonaphthalene-1,8-diol
CID 23297382
2-fluoro-8-methoxyquinoline
CID 54155138
4-[(7-bromo-8-hydroxyquinazolin-2-yl)amino]benzenesulfonamide
CID 67102003
3-bromo-2-(difluoromethyl)-6-fluorophenol
CID 130987254
2-bromobenzo[a]anthracen-1-ol
CID 88522900
2-fluoro-9-[4-(9-fluoro-1,10-phenanthrolin-2-yl)-2,5-dimethylphenyl]-1,10-phenanthroline
CID 59736407

Frequently Asked Questions

What is the IUPAC name of 7-bromo-2-fluoroquinolin-8-ol?
The IUPAC name of 7-bromo-2-fluoroquinolin-8-ol (CID 141280173) is 7-bromo-2-fluoroquinolin-8-ol.
What is the SMILES notation for 7-bromo-2-fluoroquinolin-8-ol?
The canonical SMILES for 7-bromo-2-fluoroquinolin-8-ol is Oc1c(Br)ccc2ccc(F)nc12.
What is the InChIKey of 7-bromo-2-fluoroquinolin-8-ol?
The InChIKey is IHHZSLOIUWREPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5BrFNO/c10-6-3-1-5-2-4-7(11)12-8(5)9(6)13/h1-4,13H.
What are the key properties of 7-bromo-2-fluoroquinolin-8-ol?
7-bromo-2-fluoroquinolin-8-ol has a molecular weight of 242.05 g/mol, XLogP of 2.84, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-2-fluoroquinolin-8-ol is sourced from PubChem (CID 141280173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).