2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine

C20H16N4O2 — CID 102447794

IUPAC2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine
SMILESc1ccc(Nc2c(-c3ccc4c(c3)OCCO4)nc3ccccn23)nc1
InChIInChI=1S/C20H16N4O2/c1-3-9-21-17(5-1)22-20-19(23-18-6-2-4-10-24(18)20)14-7-8-15-16(13-14)26-12-11-25-15/h1-10,13H,11-12H2,(H,21,22)
InChIKeyCDDVBBHCKFXCJV-UHFFFAOYSA-N
MW344.37 g/mol
LogP3.91
Rot. Bonds3

About 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine

2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine (PubChem CID 102447794) has the molecular formula C20H16N4O2 and a molecular weight of 344.37 g/mol. Its IUPAC name is 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine
PubChem CID102447794
Molecular FormulaC20H16N4O2
Molecular Weight344.37 g/mol
Exact Mass344.13
IUPAC Name2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine
SMILESc1ccc(Nc2c(-c3ccc4c(c3)OCCO4)nc3ccccn23)nc1
InChIInChI=1S/C20H16N4O2/c1-3-9-21-17(5-1)22-20-19(23-18-6-2-4-10-24(18)20)14-7-8-15-16(13-14)26-12-11-25-15/h1-10,13H,11-12H2,(H,21,22)
InChIKeyCDDVBBHCKFXCJV-UHFFFAOYSA-N
XLogP3.91
TPSA60.68 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine (CID 102447794) is 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine is c1ccc(Nc2c(-c3ccc4c(c3)OCCO4)nc3ccccn23)nc1.
What is the InChIKey of 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is CDDVBBHCKFXCJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O2/c1-3-9-21-17(5-1)22-20-19(23-18-6-2-4-10-24(18)20)14-7-8-15-16(13-14)26-12-11-25-15/h1-10,13H,11-12H2,(H,21,22).
What are the key properties of 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine?
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 344.37 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 102447794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).