5-methyl-N-(oxolan-3-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

C14H15F3N4O2 — CID 118781769

IUPAC5-methyl-N-(oxolan-3-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCc1cc(C(F)(F)F)n2nc(C(=O)NCC3CCOC3)cc2n1
InChIInChI=1S/C14H15F3N4O2/c1-8-4-11(14(15,16)17)21-12(19-8)5-10(20-21)13(22)18-6-9-2-3-23-7-9/h4-5,9H,2-3,6-7H2,1H3,(H,18,22)
InChIKeyUZHMNDWQEGYDDG-UHFFFAOYSA-N
MW328.29 g/mol
LogP1.82
Rot. Bonds3

About 5-methyl-N-(oxolan-3-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

5-methyl-N-(oxolan-3-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 118781769) has the molecular formula C14H15F3N4O2 and a molecular weight of 328.29 g/mol. Its IUPAC name is 5-methyl-N-(oxolan-3-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(oxolan-3-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID118781769
Molecular FormulaC14H15F3N4O2
Molecular Weight328.29 g/mol
Exact Mass328.11
IUPAC Name5-methyl-N-(oxolan-3-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCc1cc(C(F)(F)F)n2nc(C(=O)NCC3CCOC3)cc2n1
InChIInChI=1S/C14H15F3N4O2/c1-8-4-11(14(15,16)17)21-12(19-8)5-10(20-21)13(22)18-6-9-2-3-23-7-9/h4-5,9H,2-3,6-7H2,1H3,(H,18,22)
InChIKeyUZHMNDWQEGYDDG-UHFFFAOYSA-N
XLogP1.82
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.29
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-methyl-N-(oxolan-3-ylmethyl)-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-methyl-N-(oxolan-3-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of 5-methyl-N-(oxolan-3-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide (CID 118781769) is 5-methyl-N-(oxolan-3-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for 5-methyl-N-(oxolan-3-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for 5-methyl-N-(oxolan-3-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide is Cc1cc(C(F)(F)F)n2nc(C(=O)NCC3CCOC3)cc2n1.
What is the InChIKey of 5-methyl-N-(oxolan-3-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is UZHMNDWQEGYDDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F3N4O2/c1-8-4-11(14(15,16)17)21-12(19-8)5-10(20-21)13(22)18-6-9-2-3-23-7-9/h4-5,9H,2-3,6-7H2,1H3,(H,18,22).
What are the key properties of 5-methyl-N-(oxolan-3-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
5-methyl-N-(oxolan-3-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 328.29 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(oxolan-3-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 118781769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).