2-methyl-1-(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)propan-1-one

C10H12N2OS — CID 112713651

IUPAC2-methyl-1-(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)propan-1-one
SMILESCc1c(C(=O)C(C)C)sc2nccn12
InChIInChI=1S/C10H12N2OS/c1-6(2)8(13)9-7(3)12-5-4-11-10(12)14-9/h4-6H,1-3H3
InChIKeyPOXIUSRBISCYAR-UHFFFAOYSA-N
MW208.29 g/mol
LogP2.54
Rot. Bonds2

About 2-methyl-1-(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)propan-1-one

2-methyl-1-(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)propan-1-one (PubChem CID 112713651) has the molecular formula C10H12N2OS and a molecular weight of 208.29 g/mol. Its IUPAC name is 2-methyl-1-(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)propan-1-one.

Molecular Properties

Compound Name2-methyl-1-(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)propan-1-one
PubChem CID112713651
Molecular FormulaC10H12N2OS
Molecular Weight208.29 g/mol
Exact Mass208.07
IUPAC Name2-methyl-1-(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)propan-1-one
SMILESCc1c(C(=O)C(C)C)sc2nccn12
InChIInChI=1S/C10H12N2OS/c1-6(2)8(13)9-7(3)12-5-4-11-10(12)14-9/h4-6H,1-3H3
InChIKeyPOXIUSRBISCYAR-UHFFFAOYSA-N
XLogP2.54
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.29
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 3-methylimidazo[2,1-b][1,3]thiazole-2-carboxylate
CID 14801951
3-methylimidazo[2,1-b][1,3]thiazole-2-carboximidamide
CID 83875469
methyl N,3-dimethylimidazo[2,1-b][1,3]thiazole-2-carboximidate
CID 163588493
3-methyl-N-[1-(3-methylbutanoyl)piperidin-4-yl]imidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 154736522
carbanide;2,3-dimethylimidazo[2,1-b][1,3]thiazole;methane;tungsten
CID 158024246
3-methyl-N-[1-(5-methyl-1H-imidazol-2-yl)propyl]imidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 166245430
3-methyl-N-[4-[2-(methylamino)ethyl]phenyl]imidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 166326490
3-methyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]imidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 154737089
(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)methanamine
CID 82503049
3-(3-methylphenyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid
CID 82225466
1-[3-amino-5-[methyl-[(1-methylimidazol-2-yl)methyl]amino]thiophen-2-yl]-2-methylpropan-1-one
CID 103421941
2-methyl-1-(1-propan-2-ylimidazol-2-yl)propan-1-one
CID 83388605

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)propan-1-one?
The IUPAC name of 2-methyl-1-(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)propan-1-one (CID 112713651) is 2-methyl-1-(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)propan-1-one.
What is the SMILES notation for 2-methyl-1-(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)propan-1-one?
The canonical SMILES for 2-methyl-1-(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)propan-1-one is Cc1c(C(=O)C(C)C)sc2nccn12.
What is the InChIKey of 2-methyl-1-(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)propan-1-one?
The InChIKey is POXIUSRBISCYAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2OS/c1-6(2)8(13)9-7(3)12-5-4-11-10(12)14-9/h4-6H,1-3H3.
What are the key properties of 2-methyl-1-(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)propan-1-one?
2-methyl-1-(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)propan-1-one has a molecular weight of 208.29 g/mol, XLogP of 2.54, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)propan-1-one is sourced from PubChem (CID 112713651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).