5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine

C14H13N3 — CID 737207

IUPAC5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine
SMILESCc1cc(C)n2nc(-c3ccccc3)cc2n1
InChIInChI=1S/C14H13N3/c1-10-8-11(2)17-14(15-10)9-13(16-17)12-6-4-3-5-7-12/h3-9H,1-2H3
InChIKeyAZWWKRAUFGDLEV-UHFFFAOYSA-N
MW223.28 g/mol
LogP3.01
Rot. Bonds1

About 5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine

5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine (PubChem CID 737207) has the molecular formula C14H13N3 and a molecular weight of 223.28 g/mol. Its IUPAC name is 5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine
PubChem CID737207
Molecular FormulaC14H13N3
Molecular Weight223.28 g/mol
Exact Mass223.11
IUPAC Name5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine
SMILESCc1cc(C)n2nc(-c3ccccc3)cc2n1
InChIInChI=1S/C14H13N3/c1-10-8-11(2)17-14(15-10)9-13(16-17)12-6-4-3-5-7-12/h3-9H,1-2H3
InChIKeyAZWWKRAUFGDLEV-UHFFFAOYSA-N
XLogP3.01
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine 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-2-phenylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine (CID 737207) is 5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine is Cc1cc(C)n2nc(-c3ccccc3)cc2n1.
What is the InChIKey of 5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine?
The InChIKey is AZWWKRAUFGDLEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3/c1-10-8-11(2)17-14(15-10)9-13(16-17)12-6-4-3-5-7-12/h3-9H,1-2H3.
What are the key properties of 5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine?
5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine has a molecular weight of 223.28 g/mol, XLogP of 3.01, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 737207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).