5,7-dimethyl-N-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

C16H16N4O — CID 974413

IUPAC5,7-dimethyl-N-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCc1ccc(NC(=O)c2cc3nc(C)cc(C)n3n2)cc1
InChIInChI=1S/C16H16N4O/c1-10-4-6-13(7-5-10)18-16(21)14-9-15-17-11(2)8-12(3)20(15)19-14/h4-9H,1-3H3,(H,18,21)
InChIKeyCEOCFEDVQRWVAI-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.91
Rot. Bonds2

About 5,7-dimethyl-N-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

5,7-dimethyl-N-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 974413) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is 5,7-dimethyl-N-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound Name5,7-dimethyl-N-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID974413
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC Name5,7-dimethyl-N-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCc1ccc(NC(=O)c2cc3nc(C)cc(C)n3n2)cc1
InChIInChI=1S/C16H16N4O/c1-10-4-6-13(7-5-10)18-16(21)14-9-15-17-11(2)8-12(3)20(15)19-14/h4-9H,1-3H3,(H,18,21)
InChIKeyCEOCFEDVQRWVAI-UHFFFAOYSA-N
XLogP2.91
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5,7-dimethyl-N-(4-methylphenyl)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 5,7-dimethyl-N-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of 5,7-dimethyl-N-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide (CID 974413) is 5,7-dimethyl-N-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for 5,7-dimethyl-N-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for 5,7-dimethyl-N-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide is Cc1ccc(NC(=O)c2cc3nc(C)cc(C)n3n2)cc1.
What is the InChIKey of 5,7-dimethyl-N-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is CEOCFEDVQRWVAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c1-10-4-6-13(7-5-10)18-16(21)14-9-15-17-11(2)8-12(3)20(15)19-14/h4-9H,1-3H3,(H,18,21).
What are the key properties of 5,7-dimethyl-N-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
5,7-dimethyl-N-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 280.33 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethyl-N-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 974413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).