2-(4-methylsulfanylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine

C19H15N3S — CID 19022699

IUPAC2-(4-methylsulfanylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine
SMILESCSc1ccc(-c2nc3ccccn3c2-c2ccncc2)cc1
InChIInChI=1S/C19H15N3S/c1-23-16-7-5-14(6-8-16)18-19(15-9-11-20-12-10-15)22-13-3-2-4-17(22)21-18/h2-13H,1H3
InChIKeyUALXZKVLXOTDSG-UHFFFAOYSA-N
MW317.42 g/mol
LogP4.79
Rot. Bonds3

About 2-(4-methylsulfanylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine

2-(4-methylsulfanylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine (PubChem CID 19022699) has the molecular formula C19H15N3S and a molecular weight of 317.42 g/mol. Its IUPAC name is 2-(4-methylsulfanylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-(4-methylsulfanylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine
PubChem CID19022699
Molecular FormulaC19H15N3S
Molecular Weight317.42 g/mol
Exact Mass317.10
IUPAC Name2-(4-methylsulfanylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine
SMILESCSc1ccc(-c2nc3ccccn3c2-c2ccncc2)cc1
InChIInChI=1S/C19H15N3S/c1-23-16-7-5-14(6-8-16)18-19(15-9-11-20-12-10-15)22-13-3-2-4-17(22)21-18/h2-13H,1H3
InChIKeyUALXZKVLXOTDSG-UHFFFAOYSA-N
XLogP4.79
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.42
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methylsulfanylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine?
The IUPAC name of 2-(4-methylsulfanylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine (CID 19022699) is 2-(4-methylsulfanylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-(4-methylsulfanylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine?
The canonical SMILES for 2-(4-methylsulfanylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine is CSc1ccc(-c2nc3ccccn3c2-c2ccncc2)cc1.
What is the InChIKey of 2-(4-methylsulfanylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine?
The InChIKey is UALXZKVLXOTDSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3S/c1-23-16-7-5-14(6-8-16)18-19(15-9-11-20-12-10-15)22-13-3-2-4-17(22)21-18/h2-13H,1H3.
What are the key properties of 2-(4-methylsulfanylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine?
2-(4-methylsulfanylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine has a molecular weight of 317.42 g/mol, XLogP of 4.79, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylsulfanylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine is sourced from PubChem (CID 19022699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).