2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridine

C14H9ClN2O2 — CID 5190275

IUPAC2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridine
SMILESClc1ccc2nc(-c3ccc4c(c3)OCO4)cn2c1
InChIInChI=1S/C14H9ClN2O2/c15-10-2-4-14-16-11(7-17(14)6-10)9-1-3-12-13(5-9)19-8-18-12/h1-7H,8H2
InChIKeyAWNGFBUYGOWSNY-UHFFFAOYSA-N
MW272.69 g/mol
LogP3.38
Rot. Bonds1

About 2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridine

2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridine (PubChem CID 5190275) has the molecular formula C14H9ClN2O2 and a molecular weight of 272.69 g/mol. Its IUPAC name is 2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridine
PubChem CID5190275
Molecular FormulaC14H9ClN2O2
Molecular Weight272.69 g/mol
Exact Mass272.04
IUPAC Name2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridine
SMILESClc1ccc2nc(-c3ccc4c(c3)OCO4)cn2c1
InChIInChI=1S/C14H9ClN2O2/c15-10-2-4-14-16-11(7-17(14)6-10)9-1-3-12-13(5-9)19-8-18-12/h1-7H,8H2
InChIKeyAWNGFBUYGOWSNY-UHFFFAOYSA-N
XLogP3.38
TPSA35.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.69
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridine?
The IUPAC name of 2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridine (CID 5190275) is 2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridine?
The canonical SMILES for 2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridine is Clc1ccc2nc(-c3ccc4c(c3)OCO4)cn2c1.
What is the InChIKey of 2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridine?
The InChIKey is AWNGFBUYGOWSNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClN2O2/c15-10-2-4-14-16-11(7-17(14)6-10)9-1-3-12-13(5-9)19-8-18-12/h1-7H,8H2.
What are the key properties of 2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridine?
2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridine has a molecular weight of 272.69 g/mol, XLogP of 3.38, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridine is sourced from PubChem (CID 5190275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).