5-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

C14H11F3N6OS — CID 1457977

IUPAC5-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCc1nnc(NC(=O)c2cc3nc(C4CC4)cc(C(F)(F)F)n3n2)s1
InChIInChI=1S/C14H11F3N6OS/c1-6-20-21-13(25-6)19-12(24)9-5-11-18-8(7-2-3-7)4-10(14(15,16)17)23(11)22-9/h4-5,7H,2-3H2,1H3,(H,19,21,24)
InChIKeyFLJLUOSCONIDEP-UHFFFAOYSA-N
MW368.34 g/mol
LogP3.04
Rot. Bonds3

About 5-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

5-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 1457977) has the molecular formula C14H11F3N6OS and a molecular weight of 368.34 g/mol. Its IUPAC name is 5-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID1457977
Molecular FormulaC14H11F3N6OS
Molecular Weight368.34 g/mol
Exact Mass368.07
IUPAC Name5-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCc1nnc(NC(=O)c2cc3nc(C4CC4)cc(C(F)(F)F)n3n2)s1
InChIInChI=1S/C14H11F3N6OS/c1-6-20-21-13(25-6)19-12(24)9-5-11-18-8(7-2-3-7)4-10(14(15,16)17)23(11)22-9/h4-5,7H,2-3H2,1H3,(H,19,21,24)
InChIKeyFLJLUOSCONIDEP-UHFFFAOYSA-N
XLogP3.04
TPSA85.07 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.34
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-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-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of 5-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide (CID 1457977) is 5-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide is Cc1nnc(NC(=O)c2cc3nc(C4CC4)cc(C(F)(F)F)n3n2)s1.
What is the InChIKey of 5-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is FLJLUOSCONIDEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F3N6OS/c1-6-20-21-13(25-6)19-12(24)9-5-11-18-8(7-2-3-7)4-10(14(15,16)17)23(11)22-9/h4-5,7H,2-3H2,1H3,(H,19,21,24).
What are the key properties of 5-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
5-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 368.34 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 1457977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).