N-(2,6-dimethylphenyl)-5-methyl-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine

C20H19N3S — CID 4288210

IUPACN-(2,6-dimethylphenyl)-5-methyl-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine
SMILESCc1cccc(C)c1Nc1c(-c2ccsc2)nc2cccc(C)n12
InChIInChI=1S/C20H19N3S/c1-13-6-4-7-14(2)18(13)22-20-19(16-10-11-24-12-16)21-17-9-5-8-15(3)23(17)20/h4-12,22H,1-3H3
InChIKeyQVYZFFPQNHEJDT-UHFFFAOYSA-N
MW333.46 g/mol
LogP5.73
Rot. Bonds3

About N-(2,6-dimethylphenyl)-5-methyl-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine

N-(2,6-dimethylphenyl)-5-methyl-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine (PubChem CID 4288210) has the molecular formula C20H19N3S and a molecular weight of 333.46 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-5-methyl-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-5-methyl-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine
PubChem CID4288210
Molecular FormulaC20H19N3S
Molecular Weight333.46 g/mol
Exact Mass333.13
IUPAC NameN-(2,6-dimethylphenyl)-5-methyl-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine
SMILESCc1cccc(C)c1Nc1c(-c2ccsc2)nc2cccc(C)n12
InChIInChI=1S/C20H19N3S/c1-13-6-4-7-14(2)18(13)22-20-19(16-10-11-24-12-16)21-17-9-5-8-15(3)23(17)20/h4-12,22H,1-3H3
InChIKeyQVYZFFPQNHEJDT-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 N-(2,6-dimethylphenyl)-5-methyl-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of N-(2,6-dimethylphenyl)-5-methyl-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine (CID 4288210) is N-(2,6-dimethylphenyl)-5-methyl-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for N-(2,6-dimethylphenyl)-5-methyl-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for N-(2,6-dimethylphenyl)-5-methyl-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine is Cc1cccc(C)c1Nc1c(-c2ccsc2)nc2cccc(C)n12.
What is the InChIKey of N-(2,6-dimethylphenyl)-5-methyl-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is QVYZFFPQNHEJDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3S/c1-13-6-4-7-14(2)18(13)22-20-19(16-10-11-24-12-16)21-17-9-5-8-15(3)23(17)20/h4-12,22H,1-3H3.
What are the key properties of N-(2,6-dimethylphenyl)-5-methyl-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine?
N-(2,6-dimethylphenyl)-5-methyl-2-thiophen-3-ylimidazo[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 N-(2,6-dimethylphenyl)-5-methyl-2-thiophen-3-ylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 4288210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).