(3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol

C8H6BrFN2O — CID 130065270

IUPAC(3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol
SMILESOCc1ccn2c(Br)cnc2c1F
InChIInChI=1S/C8H6BrFN2O/c9-6-3-11-8-7(10)5(4-13)1-2-12(6)8/h1-3,13H,4H2
InChIKeyQIOIGSHJBCUBFU-UHFFFAOYSA-N
MW245.05 g/mol
LogP1.73
Rot. Bonds1

About (3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol

(3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol (PubChem CID 130065270) has the molecular formula C8H6BrFN2O and a molecular weight of 245.05 g/mol. Its IUPAC name is (3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol.

Molecular Properties

Compound Name(3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol
PubChem CID130065270
Molecular FormulaC8H6BrFN2O
Molecular Weight245.05 g/mol
Exact Mass243.96
IUPAC Name(3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol
SMILESOCc1ccn2c(Br)cnc2c1F
InChIInChI=1S/C8H6BrFN2O/c9-6-3-11-8-7(10)5(4-13)1-2-12(6)8/h1-3,13H,4H2
InChIKeyQIOIGSHJBCUBFU-UHFFFAOYSA-N
XLogP1.73
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.05
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol?
The IUPAC name of (3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol (CID 130065270) is (3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol.
What is the SMILES notation for (3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol?
The canonical SMILES for (3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol is OCc1ccn2c(Br)cnc2c1F.
What is the InChIKey of (3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol?
The InChIKey is QIOIGSHJBCUBFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6BrFN2O/c9-6-3-11-8-7(10)5(4-13)1-2-12(6)8/h1-3,13H,4H2.
What are the key properties of (3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol?
(3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol has a molecular weight of 245.05 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol is sourced from PubChem (CID 130065270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).