(5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol

C15H10BrFN2O — CID 105113707

IUPAC(5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol
SMILESOC(c1cc(Br)ccc1F)c1cccc2nccnc12
InChIInChI=1S/C15H10BrFN2O/c16-9-4-5-12(17)11(8-9)15(20)10-2-1-3-13-14(10)19-7-6-18-13/h1-8,15,20H
InChIKeyUUMNCMVUPGLUAI-UHFFFAOYSA-N
MW333.16 g/mol
LogP3.61
Rot. Bonds2

About (5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol

(5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol (PubChem CID 105113707) has the molecular formula C15H10BrFN2O and a molecular weight of 333.16 g/mol. Its IUPAC name is (5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol.

Molecular Properties

Compound Name(5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol
PubChem CID105113707
Molecular FormulaC15H10BrFN2O
Molecular Weight333.16 g/mol
Exact Mass332.00
IUPAC Name(5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol
SMILESOC(c1cc(Br)ccc1F)c1cccc2nccnc12
InChIInChI=1S/C15H10BrFN2O/c16-9-4-5-12(17)11(8-9)15(20)10-2-1-3-13-14(10)19-7-6-18-13/h1-8,15,20H
InChIKeyUUMNCMVUPGLUAI-UHFFFAOYSA-N
XLogP3.61
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.16
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-bromo-2-fluorophenyl)-quinolin-8-ylmethanol
CID 79742263
(4-chlorophenyl)-quinoxalin-5-ylmethanol
CID 105120341
(5-bromo-2-fluorophenyl)-naphthalen-1-ylmethanol
CID 63894699
(5-bromo-2-fluorophenyl)-quinoxalin-2-ylmethanol
CID 107357691
(5-bromo-2-fluorophenyl)-quinolin-7-ylmethanol
CID 81215821
(5-bromo-2-fluorophenyl)-(2-methylphenyl)methanol
CID 63894128
(5-bromo-2-fluorophenyl)-(2-fluoro-3-methoxyphenyl)methanol
CID 82805632
1-quinoxalin-5-ylprop-2-yn-1-ol
CID 105106188
(5-bromo-2-fluorophenyl)-(3-fluorophenyl)methanol
CID 63893368
(2-amino-5-bromophenyl)-quinolin-8-ylmethanol
CID 82704162
(5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol
CID 79742828
(5-bromo-2-fluorophenyl)-(2,4,5-trimethylphenyl)methanol
CID 64985386

Frequently Asked Questions

What is the IUPAC name of (5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol?
The IUPAC name of (5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol (CID 105113707) is (5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol.
What is the SMILES notation for (5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol?
The canonical SMILES for (5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol is OC(c1cc(Br)ccc1F)c1cccc2nccnc12.
What is the InChIKey of (5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol?
The InChIKey is UUMNCMVUPGLUAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrFN2O/c16-9-4-5-12(17)11(8-9)15(20)10-2-1-3-13-14(10)19-7-6-18-13/h1-8,15,20H.
What are the key properties of (5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol?
(5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol has a molecular weight of 333.16 g/mol, XLogP of 3.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol is sourced from PubChem (CID 105113707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).