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

C8H6Cl2N2O — CID 82530130

IUPAC(2,7-dichloroimidazo[1,2-a]pyridin-3-yl)methanol
SMILESOCc1c(Cl)nc2cc(Cl)ccn12
InChIInChI=1S/C8H6Cl2N2O/c9-5-1-2-12-6(4-13)8(10)11-7(12)3-5/h1-3,13H,4H2
InChIKeyNVARCIHSLXEGTE-UHFFFAOYSA-N
MW217.06 g/mol
LogP2.13
Rot. Bonds1

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

(2,7-dichloroimidazo[1,2-a]pyridin-3-yl)methanol (PubChem CID 82530130) has the molecular formula C8H6Cl2N2O and a molecular weight of 217.06 g/mol. Its IUPAC name is (2,7-dichloroimidazo[1,2-a]pyridin-3-yl)methanol.

Molecular Properties

Compound Name(2,7-dichloroimidazo[1,2-a]pyridin-3-yl)methanol
PubChem CID82530130
Molecular FormulaC8H6Cl2N2O
Molecular Weight217.06 g/mol
Exact Mass215.99
IUPAC Name(2,7-dichloroimidazo[1,2-a]pyridin-3-yl)methanol
SMILESOCc1c(Cl)nc2cc(Cl)ccn12
InChIInChI=1S/C8H6Cl2N2O/c9-5-1-2-12-6(4-13)8(10)11-7(12)3-5/h1-3,13H,4H2
InChIKeyNVARCIHSLXEGTE-UHFFFAOYSA-N
XLogP2.13
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.06
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2,7-dichloroimidazo[1,2-a]pyridin-3-yl)methanol?
The IUPAC name of (2,7-dichloroimidazo[1,2-a]pyridin-3-yl)methanol (CID 82530130) is (2,7-dichloroimidazo[1,2-a]pyridin-3-yl)methanol.
What is the SMILES notation for (2,7-dichloroimidazo[1,2-a]pyridin-3-yl)methanol?
The canonical SMILES for (2,7-dichloroimidazo[1,2-a]pyridin-3-yl)methanol is OCc1c(Cl)nc2cc(Cl)ccn12.
What is the InChIKey of (2,7-dichloroimidazo[1,2-a]pyridin-3-yl)methanol?
The InChIKey is NVARCIHSLXEGTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6Cl2N2O/c9-5-1-2-12-6(4-13)8(10)11-7(12)3-5/h1-3,13H,4H2.
What are the key properties of (2,7-dichloroimidazo[1,2-a]pyridin-3-yl)methanol?
(2,7-dichloroimidazo[1,2-a]pyridin-3-yl)methanol has a molecular weight of 217.06 g/mol, XLogP of 2.13, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,7-dichloroimidazo[1,2-a]pyridin-3-yl)methanol is sourced from PubChem (CID 82530130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).