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

C10H6F6N4O — CID 2821149

IUPACN-methyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCNC(=O)c1cnn2c(C(F)(F)F)cc(C(F)(F)F)nc12
InChIInChI=1S/C10H6F6N4O/c1-17-8(21)4-3-18-20-6(10(14,15)16)2-5(9(11,12)13)19-7(4)20/h2-3H,1H3,(H,17,21)
InChIKeyQPNFVFHCJGWQAJ-UHFFFAOYSA-N
MW312.17 g/mol
LogP2.13
Rot. Bonds1

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

N-methyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 2821149) has the molecular formula C10H6F6N4O and a molecular weight of 312.17 g/mol. Its IUPAC name is N-methyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID2821149
Molecular FormulaC10H6F6N4O
Molecular Weight312.17 g/mol
Exact Mass312.04
IUPAC NameN-methyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCNC(=O)c1cnn2c(C(F)(F)F)cc(C(F)(F)F)nc12
InChIInChI=1S/C10H6F6N4O/c1-17-8(21)4-3-18-20-6(10(14,15)16)2-5(9(11,12)13)19-7(4)20/h2-3H,1H3,(H,17,21)
InChIKeyQPNFVFHCJGWQAJ-UHFFFAOYSA-N
XLogP2.13
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.17
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-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 N-methyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-methyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 2821149) is N-methyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-methyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-methyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is CNC(=O)c1cnn2c(C(F)(F)F)cc(C(F)(F)F)nc12.
What is the InChIKey of N-methyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is QPNFVFHCJGWQAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F6N4O/c1-17-8(21)4-3-18-20-6(10(14,15)16)2-5(9(11,12)13)19-7(4)20/h2-3H,1H3,(H,17,21).
What are the key properties of N-methyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-methyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 312.17 g/mol, XLogP of 2.13, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 2821149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).