5-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide

C15H18N4O3S2 — CID 21008545

IUPAC5-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
SMILESCc1csc(NC(=O)c2cc(C3CC3)n(C3CCS(=O)(=O)C3)n2)n1
InChIInChI=1S/C15H18N4O3S2/c1-9-7-23-15(16-9)17-14(20)12-6-13(10-2-3-10)19(18-12)11-4-5-24(21,22)8-11/h6-7,10-11H,2-5,8H2,1H3,(H,16,17,20)
InChIKeyFMUFXGUQJLQWTG-UHFFFAOYSA-N
MW366.47 g/mol
LogP2.14
Rot. Bonds4

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

5-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide (PubChem CID 21008545) has the molecular formula C15H18N4O3S2 and a molecular weight of 366.47 g/mol. Its IUPAC name is 5-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
PubChem CID21008545
Molecular FormulaC15H18N4O3S2
Molecular Weight366.47 g/mol
Exact Mass366.08
IUPAC Name5-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
SMILESCc1csc(NC(=O)c2cc(C3CC3)n(C3CCS(=O)(=O)C3)n2)n1
InChIInChI=1S/C15H18N4O3S2/c1-9-7-23-15(16-9)17-14(20)12-6-13(10-2-3-10)19(18-12)11-4-5-24(21,22)8-11/h6-7,10-11H,2-5,8H2,1H3,(H,16,17,20)
InChIKeyFMUFXGUQJLQWTG-UHFFFAOYSA-N
XLogP2.14
TPSA93.95 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-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 5-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide (CID 21008545) is 5-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide is Cc1csc(NC(=O)c2cc(C3CC3)n(C3CCS(=O)(=O)C3)n2)n1.
What is the InChIKey of 5-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
The InChIKey is FMUFXGUQJLQWTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O3S2/c1-9-7-23-15(16-9)17-14(20)12-6-13(10-2-3-10)19(18-12)11-4-5-24(21,22)8-11/h6-7,10-11H,2-5,8H2,1H3,(H,16,17,20).
What are the key properties of 5-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
5-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide has a molecular weight of 366.47 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-1-(1,1-dioxothiolan-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide is sourced from PubChem (CID 21008545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).