methyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate

C10H11N3O2S — CID 103570067

IUPACmethyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate
SMILESCCn1cc(-c2ncc(C(=O)OC)s2)cn1
InChIInChI=1S/C10H11N3O2S/c1-3-13-6-7(4-12-13)9-11-5-8(16-9)10(14)15-2/h4-6H,3H2,1-2H3
InChIKeySELKTDAKLBZGRG-UHFFFAOYSA-N
MW237.28 g/mol
LogP1.81
Rot. Bonds3

About methyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate

methyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate (PubChem CID 103570067) has the molecular formula C10H11N3O2S and a molecular weight of 237.28 g/mol. Its IUPAC name is methyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate.

Molecular Properties

Compound Namemethyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate
PubChem CID103570067
Molecular FormulaC10H11N3O2S
Molecular Weight237.28 g/mol
Exact Mass237.06
IUPAC Namemethyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate
SMILESCCn1cc(-c2ncc(C(=O)OC)s2)cn1
InChIInChI=1S/C10H11N3O2S/c1-3-13-6-7(4-12-13)9-11-5-8(16-9)10(14)15-2/h4-6H,3H2,1-2H3
InChIKeySELKTDAKLBZGRG-UHFFFAOYSA-N
XLogP1.81
TPSA57.01 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.28
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze methyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate 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

methyl 2-(1-propylpyrazol-4-yl)-1,3-thiazole-5-carboxylate
CID 103572384
methyl 2-(4-fluorophenyl)-1,3-thiazole-5-carboxylate
CID 57362704
methyl 4-amino-3-(1-ethylpyrazol-4-yl)benzoate
CID 156613093
methyl 2-[4-(difluoromethyl)phenyl]-1,3-thiazole-5-carboxylate
CID 115524717
methyl 2-(1-methyltriazol-4-yl)-1,3-thiazole-5-carboxylate
CID 130598615
methyl 2-(3-propylimidazol-4-yl)-1,3-thiazole-5-carboxylate
CID 80573879
4-ethyl-2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylic acid
CID 103570070
methyl 2-(4-bromo-3-methylphenyl)-1,3-thiazole-5-carboxylate
CID 80574021
methyl 2-[2-(1-ethylpyrazol-4-yl)-1,3-thiazol-4-yl]-2-methylpropanoate
CID 112752355
methyl 4-[[4-(1-ethylpyrazol-4-yl)-5-(trifluoromethyl)pyrimidin-2-yl]amino]benzoate
CID 141359201
methyl 2-(1-methyl-2,3-dihydroindol-5-yl)-1,3-thiazole-5-carboxylate
CID 80573858
2-(4-ethylphenyl)-1,3-thiazole-5-carboxylic acid
CID 43156460

Frequently Asked Questions

What is the IUPAC name of methyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate?
The IUPAC name of methyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate (CID 103570067) is methyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate.
What is the SMILES notation for methyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate?
The canonical SMILES for methyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate is CCn1cc(-c2ncc(C(=O)OC)s2)cn1.
What is the InChIKey of methyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate?
The InChIKey is SELKTDAKLBZGRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2S/c1-3-13-6-7(4-12-13)9-11-5-8(16-9)10(14)15-2/h4-6H,3H2,1-2H3.
What are the key properties of methyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate?
methyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate has a molecular weight of 237.28 g/mol, XLogP of 1.81, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(1-ethylpyrazol-4-yl)-1,3-thiazole-5-carboxylate is sourced from PubChem (CID 103570067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).