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

C9H9BrN2O — CID 115044017

IUPAC(7-bromo-3-methylimidazo[1,2-a]pyridin-2-yl)methanol
SMILESCc1c(CO)nc2cc(Br)ccn12
InChIInChI=1S/C9H9BrN2O/c1-6-8(5-13)11-9-4-7(10)2-3-12(6)9/h2-4,13H,5H2,1H3
InChIKeyMXWXDURZDCLAQK-UHFFFAOYSA-N
MW241.09 g/mol
LogP1.90
Rot. Bonds1

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

(7-bromo-3-methylimidazo[1,2-a]pyridin-2-yl)methanol (PubChem CID 115044017) has the molecular formula C9H9BrN2O and a molecular weight of 241.09 g/mol. Its IUPAC name is (7-bromo-3-methylimidazo[1,2-a]pyridin-2-yl)methanol.

Molecular Properties

Compound Name(7-bromo-3-methylimidazo[1,2-a]pyridin-2-yl)methanol
PubChem CID115044017
Molecular FormulaC9H9BrN2O
Molecular Weight241.09 g/mol
Exact Mass239.99
IUPAC Name(7-bromo-3-methylimidazo[1,2-a]pyridin-2-yl)methanol
SMILESCc1c(CO)nc2cc(Br)ccn12
InChIInChI=1S/C9H9BrN2O/c1-6-8(5-13)11-9-4-7(10)2-3-12(6)9/h2-4,13H,5H2,1H3
InChIKeyMXWXDURZDCLAQK-UHFFFAOYSA-N
XLogP1.90
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.09
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (7-bromo-3-methylimidazo[1,2-a]pyridin-2-yl)methanol?
The IUPAC name of (7-bromo-3-methylimidazo[1,2-a]pyridin-2-yl)methanol (CID 115044017) is (7-bromo-3-methylimidazo[1,2-a]pyridin-2-yl)methanol.
What is the SMILES notation for (7-bromo-3-methylimidazo[1,2-a]pyridin-2-yl)methanol?
The canonical SMILES for (7-bromo-3-methylimidazo[1,2-a]pyridin-2-yl)methanol is Cc1c(CO)nc2cc(Br)ccn12.
What is the InChIKey of (7-bromo-3-methylimidazo[1,2-a]pyridin-2-yl)methanol?
The InChIKey is MXWXDURZDCLAQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9BrN2O/c1-6-8(5-13)11-9-4-7(10)2-3-12(6)9/h2-4,13H,5H2,1H3.
What are the key properties of (7-bromo-3-methylimidazo[1,2-a]pyridin-2-yl)methanol?
(7-bromo-3-methylimidazo[1,2-a]pyridin-2-yl)methanol has a molecular weight of 241.09 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7-bromo-3-methylimidazo[1,2-a]pyridin-2-yl)methanol is sourced from PubChem (CID 115044017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).