8-methyl-N-(2-methylphenyl)-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine

C20H19N3S — CID 3473379

IUPAC8-methyl-N-(2-methylphenyl)-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1ccc(-c2nc3c(C)cccn3c2Nc2ccccc2C)s1
InChIInChI=1S/C20H19N3S/c1-13-7-4-5-9-16(13)21-20-18(17-11-10-15(3)24-17)22-19-14(2)8-6-12-23(19)20/h4-12,21H,1-3H3
InChIKeyXSENOIRYIVQWCX-UHFFFAOYSA-N
MW333.46 g/mol
LogP5.73
Rot. Bonds3

About 8-methyl-N-(2-methylphenyl)-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine

8-methyl-N-(2-methylphenyl)-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 3473379) has the molecular formula C20H19N3S and a molecular weight of 333.46 g/mol. Its IUPAC name is 8-methyl-N-(2-methylphenyl)-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name8-methyl-N-(2-methylphenyl)-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine
PubChem CID3473379
Molecular FormulaC20H19N3S
Molecular Weight333.46 g/mol
Exact Mass333.13
IUPAC Name8-methyl-N-(2-methylphenyl)-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1ccc(-c2nc3c(C)cccn3c2Nc2ccccc2C)s1
InChIInChI=1S/C20H19N3S/c1-13-7-4-5-9-16(13)21-20-18(17-11-10-15(3)24-17)22-19-14(2)8-6-12-23(19)20/h4-12,21H,1-3H3
InChIKeyXSENOIRYIVQWCX-UHFFFAOYSA-N
XLogP5.73
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.46
LogP ≤ 55.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-N-(2-methylphenyl)-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 8-methyl-N-(2-methylphenyl)-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine (CID 3473379) is 8-methyl-N-(2-methylphenyl)-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 8-methyl-N-(2-methylphenyl)-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 8-methyl-N-(2-methylphenyl)-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine is Cc1ccc(-c2nc3c(C)cccn3c2Nc2ccccc2C)s1.
What is the InChIKey of 8-methyl-N-(2-methylphenyl)-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is XSENOIRYIVQWCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3S/c1-13-7-4-5-9-16(13)21-20-18(17-11-10-15(3)24-17)22-19-14(2)8-6-12-23(19)20/h4-12,21H,1-3H3.
What are the key properties of 8-methyl-N-(2-methylphenyl)-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine?
8-methyl-N-(2-methylphenyl)-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 333.46 g/mol, XLogP of 5.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-N-(2-methylphenyl)-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 3473379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).