1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone

C10H11N3OS — CID 65194405

IUPAC1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone
SMILESCC(=O)c1nc(-c2cn(C)nc2C)cs1
InChIInChI=1S/C10H11N3OS/c1-6-8(4-13(3)12-6)9-5-15-10(11-9)7(2)14/h4-5H,1-3H3
InChIKeySKUNABBCKOYZIF-UHFFFAOYSA-N
MW221.28 g/mol
LogP2.05
Rot. Bonds2

About 1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone

1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone (PubChem CID 65194405) has the molecular formula C10H11N3OS and a molecular weight of 221.28 g/mol. Its IUPAC name is 1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone.

Molecular Properties

Compound Name1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone
PubChem CID65194405
Molecular FormulaC10H11N3OS
Molecular Weight221.28 g/mol
Exact Mass221.06
IUPAC Name1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone
SMILESCC(=O)c1nc(-c2cn(C)nc2C)cs1
InChIInChI=1S/C10H11N3OS/c1-6-8(4-13(3)12-6)9-5-15-10(11-9)7(2)14/h4-5H,1-3H3
InChIKeySKUNABBCKOYZIF-UHFFFAOYSA-N
XLogP2.05
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.28
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(1-Ethyl-3-methyl-1H-pyrazol-4-yl)-thiazol-2-ylamine
CID 6485376
1-[4-(1,3-Dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]cyclopentan-1-amine
CID 65197342
4-(1,3-Dimethylpyrazol-4-yl)-2-(2,2,2-trifluoroethyl)-1,3-thiazole
CID 132283547
2-(Cyclopropylmethyl)-4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazole
CID 132284273
1-[5-(4-Fluorophenyl)-4-(2-methylpyrazol-3-yl)-1,3-thiazol-2-yl]ethanone
CID 142057384
2-Methyl-2-[3-(1,3-thiazol-4-yl)-4-(trifluoromethyl)pyrazol-1-yl]propanal
CID 142565795
2-[4-Fluoro-3-(1,3-thiazol-4-yl)pyrazol-1-yl]-2-methylpropanal
CID 142565873
1-[4-(2,4-Dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-3-[4-(trifluoromethyl)pyrazol-1-yl]propan-2-one
CID 161009597
4-[3-(Difluoromethyl)-1-methylpyrazol-4-yl]-2-(3,3,3-trifluoropropyl)-1,3-thiazole
CID 167873991
4,12-Dimethyl-5-thia-3,11,12-triazatricyclo[8.3.0.02,6]trideca-1(13),2(6),3,7,10-pentaen-9-one
CID 89819517
4-(1,3-Dimethylpyrazol-4-yl)-2-methyl-1,3-thiazole
CID 117760976
1-[4-(1,3-Dimethylpyrazol-4-yl)-2-methyl-1,3-thiazol-5-yl]ethanone
CID 117761130

Frequently Asked Questions

What is the IUPAC name of 1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone?
The IUPAC name of 1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone (CID 65194405) is 1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone.
What is the SMILES notation for 1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone?
The canonical SMILES for 1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone is CC(=O)c1nc(-c2cn(C)nc2C)cs1.
What is the InChIKey of 1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone?
The InChIKey is SKUNABBCKOYZIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3OS/c1-6-8(4-13(3)12-6)9-5-15-10(11-9)7(2)14/h4-5H,1-3H3.
What are the key properties of 1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone?
1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone has a molecular weight of 221.28 g/mol, XLogP of 2.05, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]ethanone is sourced from PubChem (CID 65194405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).