3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide

C16H19N3OS — CID 3048920

IUPAC3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide
SMILESCC1=C(C(=O)Nc2c(C)cc(C)cc2C)SC2=NCCN21
InChIInChI=1S/C16H19N3OS/c1-9-7-10(2)13(11(3)8-9)18-15(20)14-12(4)19-6-5-17-16(19)21-14/h7-8H,5-6H2,1-4H3,(H,18,20)
InChIKeyHEPOCOLSLPZREJ-UHFFFAOYSA-N
MW301.42 g/mol
LogP3.20
Rot. Bonds2

About 3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide

3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide (PubChem CID 3048920) has the molecular formula C16H19N3OS and a molecular weight of 301.42 g/mol. Its IUPAC name is 3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide
PubChem CID3048920
Molecular FormulaC16H19N3OS
Molecular Weight301.42 g/mol
Exact Mass301.12
IUPAC Name3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide
SMILESCC1=C(C(=O)Nc2c(C)cc(C)cc2C)SC2=NCCN21
InChIInChI=1S/C16H19N3OS/c1-9-7-10(2)13(11(3)8-9)18-15(20)14-12(4)19-6-5-17-16(19)21-14/h7-8H,5-6H2,1-4H3,(H,18,20)
InChIKeyHEPOCOLSLPZREJ-UHFFFAOYSA-N
XLogP3.20
TPSA44.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.42
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide?
The IUPAC name of 3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide (CID 3048920) is 3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide.
What is the SMILES notation for 3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide?
The canonical SMILES for 3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide is CC1=C(C(=O)Nc2c(C)cc(C)cc2C)SC2=NCCN21.
What is the InChIKey of 3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide?
The InChIKey is HEPOCOLSLPZREJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3OS/c1-9-7-10(2)13(11(3)8-9)18-15(20)14-12(4)19-6-5-17-16(19)21-14/h7-8H,5-6H2,1-4H3,(H,18,20).
What are the key properties of 3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide?
3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide has a molecular weight of 301.42 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide is sourced from PubChem (CID 3048920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).