(8-bromo-3-fluoroquinolin-5-yl)methanol

C10H7BrFNO — CID 146567212

IUPAC(8-bromo-3-fluoroquinolin-5-yl)methanol
SMILESOCc1ccc(Br)c2ncc(F)cc12
InChIInChI=1S/C10H7BrFNO/c11-9-2-1-6(5-14)8-3-7(12)4-13-10(8)9/h1-4,14H,5H2
InChIKeyDSLHZSVKBGTSFL-UHFFFAOYSA-N
MW256.07 g/mol
LogP2.63
Rot. Bonds1

About (8-bromo-3-fluoroquinolin-5-yl)methanol

(8-bromo-3-fluoroquinolin-5-yl)methanol (PubChem CID 146567212) has the molecular formula C10H7BrFNO and a molecular weight of 256.07 g/mol. Its IUPAC name is (8-bromo-3-fluoroquinolin-5-yl)methanol.

Molecular Properties

Compound Name(8-bromo-3-fluoroquinolin-5-yl)methanol
PubChem CID146567212
Molecular FormulaC10H7BrFNO
Molecular Weight256.07 g/mol
Exact Mass254.97
IUPAC Name(8-bromo-3-fluoroquinolin-5-yl)methanol
SMILESOCc1ccc(Br)c2ncc(F)cc12
InChIInChI=1S/C10H7BrFNO/c11-9-2-1-6(5-14)8-3-7(12)4-13-10(8)9/h1-4,14H,5H2
InChIKeyDSLHZSVKBGTSFL-UHFFFAOYSA-N
XLogP2.63
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.07
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (8-bromo-3-fluoroquinolin-5-yl)methanol?
The IUPAC name of (8-bromo-3-fluoroquinolin-5-yl)methanol (CID 146567212) is (8-bromo-3-fluoroquinolin-5-yl)methanol.
What is the SMILES notation for (8-bromo-3-fluoroquinolin-5-yl)methanol?
The canonical SMILES for (8-bromo-3-fluoroquinolin-5-yl)methanol is OCc1ccc(Br)c2ncc(F)cc12.
What is the InChIKey of (8-bromo-3-fluoroquinolin-5-yl)methanol?
The InChIKey is DSLHZSVKBGTSFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrFNO/c11-9-2-1-6(5-14)8-3-7(12)4-13-10(8)9/h1-4,14H,5H2.
What are the key properties of (8-bromo-3-fluoroquinolin-5-yl)methanol?
(8-bromo-3-fluoroquinolin-5-yl)methanol has a molecular weight of 256.07 g/mol, XLogP of 2.63, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8-bromo-3-fluoroquinolin-5-yl)methanol is sourced from PubChem (CID 146567212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).