4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide

C10H11ClN4OS — CID 844767

IUPAC4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
SMILESCc1csc(NC(=O)c2nn(C)c(C)c2Cl)n1
InChIInChI=1S/C10H11ClN4OS/c1-5-4-17-10(12-5)13-9(16)8-7(11)6(2)15(3)14-8/h4H,1-3H3,(H,12,13,16)
InChIKeyWDHGNIHQWYIDCA-UHFFFAOYSA-N
MW270.75 g/mol
LogP2.40
Rot. Bonds2

About 4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide

4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide (PubChem CID 844767) has the molecular formula C10H11ClN4OS and a molecular weight of 270.75 g/mol. Its IUPAC name is 4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
PubChem CID844767
Molecular FormulaC10H11ClN4OS
Molecular Weight270.75 g/mol
Exact Mass270.03
IUPAC Name4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
SMILESCc1csc(NC(=O)c2nn(C)c(C)c2Cl)n1
InChIInChI=1S/C10H11ClN4OS/c1-5-4-17-10(12-5)13-9(16)8-7(11)6(2)15(3)14-8/h4H,1-3H3,(H,12,13,16)
InChIKeyWDHGNIHQWYIDCA-UHFFFAOYSA-N
XLogP2.40
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.75
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
The IUPAC name of 4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide (CID 844767) is 4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide.
What is the SMILES notation for 4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
The canonical SMILES for 4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide is Cc1csc(NC(=O)c2nn(C)c(C)c2Cl)n1.
What is the InChIKey of 4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
The InChIKey is WDHGNIHQWYIDCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN4OS/c1-5-4-17-10(12-5)13-9(16)8-7(11)6(2)15(3)14-8/h4H,1-3H3,(H,12,13,16).
What are the key properties of 4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide has a molecular weight of 270.75 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-1,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide is sourced from PubChem (CID 844767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).