2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridine

C15H12N2O2 — CID 854979

IUPAC2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridine
SMILESc1ccn2cc(-c3ccc4c(c3)OCCO4)nc2c1
InChIInChI=1S/C15H12N2O2/c1-2-6-17-10-12(16-15(17)3-1)11-4-5-13-14(9-11)19-8-7-18-13/h1-6,9-10H,7-8H2
InChIKeyPJPWEMITJSQDRX-UHFFFAOYSA-N
MW252.27 g/mol
LogP2.77
Rot. Bonds1

About 2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridine

2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridine (PubChem CID 854979) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is 2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridine
PubChem CID854979
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridine
SMILESc1ccn2cc(-c3ccc4c(c3)OCCO4)nc2c1
InChIInChI=1S/C15H12N2O2/c1-2-6-17-10-12(16-15(17)3-1)11-4-5-13-14(9-11)19-8-7-18-13/h1-6,9-10H,7-8H2
InChIKeyPJPWEMITJSQDRX-UHFFFAOYSA-N
XLogP2.77
TPSA35.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridine?
The IUPAC name of 2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridine (CID 854979) is 2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridine?
The canonical SMILES for 2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridine is c1ccn2cc(-c3ccc4c(c3)OCCO4)nc2c1.
What is the InChIKey of 2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridine?
The InChIKey is PJPWEMITJSQDRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-2-6-17-10-12(16-15(17)3-1)11-4-5-13-14(9-11)19-8-7-18-13/h1-6,9-10H,7-8H2.
What are the key properties of 2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridine?
2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridine has a molecular weight of 252.27 g/mol, XLogP of 2.77, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 854979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).