6-methyl-N-(2-methylphenyl)-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine

C19H17N3S — CID 5165646

IUPAC6-methyl-N-(2-methylphenyl)-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine
SMILESCc1ccc2nc(-c3ccsc3)c(Nc3ccccc3C)n2c1
InChIInChI=1S/C19H17N3S/c1-13-7-8-17-21-18(15-9-10-23-12-15)19(22(17)11-13)20-16-6-4-3-5-14(16)2/h3-12,20H,1-2H3
InChIKeyBRJUFRNUDMPCHO-UHFFFAOYSA-N
MW319.43 g/mol
LogP5.42
Rot. Bonds3

About 6-methyl-N-(2-methylphenyl)-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine

6-methyl-N-(2-methylphenyl)-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine (PubChem CID 5165646) has the molecular formula C19H17N3S and a molecular weight of 319.43 g/mol. Its IUPAC name is 6-methyl-N-(2-methylphenyl)-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name6-methyl-N-(2-methylphenyl)-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine
PubChem CID5165646
Molecular FormulaC19H17N3S
Molecular Weight319.43 g/mol
Exact Mass319.11
IUPAC Name6-methyl-N-(2-methylphenyl)-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine
SMILESCc1ccc2nc(-c3ccsc3)c(Nc3ccccc3C)n2c1
InChIInChI=1S/C19H17N3S/c1-13-7-8-17-21-18(15-9-10-23-12-15)19(22(17)11-13)20-16-6-4-3-5-14(16)2/h3-12,20H,1-2H3
InChIKeyBRJUFRNUDMPCHO-UHFFFAOYSA-N
XLogP5.42
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500319.43
LogP ≤ 55.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(2-methylphenyl)-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 6-methyl-N-(2-methylphenyl)-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine (CID 5165646) is 6-methyl-N-(2-methylphenyl)-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 6-methyl-N-(2-methylphenyl)-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 6-methyl-N-(2-methylphenyl)-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine is Cc1ccc2nc(-c3ccsc3)c(Nc3ccccc3C)n2c1.
What is the InChIKey of 6-methyl-N-(2-methylphenyl)-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is BRJUFRNUDMPCHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3S/c1-13-7-8-17-21-18(15-9-10-23-12-15)19(22(17)11-13)20-16-6-4-3-5-14(16)2/h3-12,20H,1-2H3.
What are the key properties of 6-methyl-N-(2-methylphenyl)-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine?
6-methyl-N-(2-methylphenyl)-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 319.43 g/mol, XLogP of 5.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(2-methylphenyl)-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 5165646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).