(6-bromo-8-fluoroimidazo[1,2-a]pyridin-3-yl)-quinolin-6-ylmethanol

C17H11BrFN3O — CID 123899944

IUPAC(6-bromo-8-fluoroimidazo[1,2-a]pyridin-3-yl)-quinolin-6-ylmethanol
SMILESOC(c1ccc2ncccc2c1)c1cnc2c(F)cc(Br)cn12
InChIInChI=1S/C17H11BrFN3O/c18-12-7-13(19)17-21-8-15(22(17)9-12)16(23)11-3-4-14-10(6-11)2-1-5-20-14/h1-9,16,23H
InChIKeyVHMUDTPPCSVPGA-UHFFFAOYSA-N
MW372.20 g/mol
LogP3.87
Rot. Bonds2

About (6-bromo-8-fluoroimidazo[1,2-a]pyridin-3-yl)-quinolin-6-ylmethanol

(6-bromo-8-fluoroimidazo[1,2-a]pyridin-3-yl)-quinolin-6-ylmethanol (PubChem CID 123899944) has the molecular formula C17H11BrFN3O and a molecular weight of 372.20 g/mol. Its IUPAC name is (6-bromo-8-fluoroimidazo[1,2-a]pyridin-3-yl)-quinolin-6-ylmethanol.

Molecular Properties

Compound Name(6-bromo-8-fluoroimidazo[1,2-a]pyridin-3-yl)-quinolin-6-ylmethanol
PubChem CID123899944
Molecular FormulaC17H11BrFN3O
Molecular Weight372.20 g/mol
Exact Mass371.01
IUPAC Name(6-bromo-8-fluoroimidazo[1,2-a]pyridin-3-yl)-quinolin-6-ylmethanol
SMILESOC(c1ccc2ncccc2c1)c1cnc2c(F)cc(Br)cn12
InChIInChI=1S/C17H11BrFN3O/c18-12-7-13(19)17-21-8-15(22(17)9-12)16(23)11-3-4-14-10(6-11)2-1-5-20-14/h1-9,16,23H
InChIKeyVHMUDTPPCSVPGA-UHFFFAOYSA-N
XLogP3.87
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.20
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-bromo-4-fluorophenyl)-quinolin-6-ylmethanol
CID 81216485
(2-chloro-3-fluorophenyl)-quinolin-6-ylmethanol
CID 115826770
(4-bromo-2,6-difluorophenyl)-quinolin-6-ylmethanamine
CID 105021117
(5-fluoro-2-pyridinyl)-quinolin-6-ylmethanol
CID 81221058
pyridin-4-yl(quinolin-6-yl)methanol
CID 81215658
(2-amino-5-bromophenyl)-quinolin-6-ylmethanol
CID 82704078
pyrazin-2-yl(quinolin-6-yl)methanol
CID 63969432
(4-methylsulfanylphenyl)-quinolin-6-ylmethanol
CID 115826701
(2,3-difluoro-4-methylphenyl)-quinolin-6-ylmethanol
CID 107512228
(3-aminophenyl)-quinolin-6-ylmethanol
CID 106695803
(5-fluoro-2-methylphenyl)-quinolin-6-ylmethanol
CID 63095091
(5-bromo-2-fluorophenyl)-quinolin-7-ylmethanol
CID 81215821

Frequently Asked Questions

What is the IUPAC name of (6-bromo-8-fluoroimidazo[1,2-a]pyridin-3-yl)-quinolin-6-ylmethanol?
The IUPAC name of (6-bromo-8-fluoroimidazo[1,2-a]pyridin-3-yl)-quinolin-6-ylmethanol (CID 123899944) is (6-bromo-8-fluoroimidazo[1,2-a]pyridin-3-yl)-quinolin-6-ylmethanol.
What is the SMILES notation for (6-bromo-8-fluoroimidazo[1,2-a]pyridin-3-yl)-quinolin-6-ylmethanol?
The canonical SMILES for (6-bromo-8-fluoroimidazo[1,2-a]pyridin-3-yl)-quinolin-6-ylmethanol is OC(c1ccc2ncccc2c1)c1cnc2c(F)cc(Br)cn12.
What is the InChIKey of (6-bromo-8-fluoroimidazo[1,2-a]pyridin-3-yl)-quinolin-6-ylmethanol?
The InChIKey is VHMUDTPPCSVPGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11BrFN3O/c18-12-7-13(19)17-21-8-15(22(17)9-12)16(23)11-3-4-14-10(6-11)2-1-5-20-14/h1-9,16,23H.
What are the key properties of (6-bromo-8-fluoroimidazo[1,2-a]pyridin-3-yl)-quinolin-6-ylmethanol?
(6-bromo-8-fluoroimidazo[1,2-a]pyridin-3-yl)-quinolin-6-ylmethanol has a molecular weight of 372.20 g/mol, XLogP of 3.87, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-bromo-8-fluoroimidazo[1,2-a]pyridin-3-yl)-quinolin-6-ylmethanol is sourced from PubChem (CID 123899944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).