5,7-dimethyl-2-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine

C15H15N3 — CID 819031

IUPAC5,7-dimethyl-2-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine
SMILESCc1cccc(-c2cc3nc(C)cc(C)n3n2)c1
InChIInChI=1S/C15H15N3/c1-10-5-4-6-13(7-10)14-9-15-16-11(2)8-12(3)18(15)17-14/h4-9H,1-3H3
InChIKeyYWKHFVVLOQXGDQ-UHFFFAOYSA-N
MW237.31 g/mol
LogP3.32
Rot. Bonds1

About 5,7-dimethyl-2-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine

5,7-dimethyl-2-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine (PubChem CID 819031) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is 5,7-dimethyl-2-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name5,7-dimethyl-2-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine
PubChem CID819031
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC Name5,7-dimethyl-2-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine
SMILESCc1cccc(-c2cc3nc(C)cc(C)n3n2)c1
InChIInChI=1S/C15H15N3/c1-10-5-4-6-13(7-10)14-9-15-16-11(2)8-12(3)18(15)17-14/h4-9H,1-3H3
InChIKeyYWKHFVVLOQXGDQ-UHFFFAOYSA-N
XLogP3.32
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,7-dimethyl-2-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 5,7-dimethyl-2-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine (CID 819031) is 5,7-dimethyl-2-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 5,7-dimethyl-2-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 5,7-dimethyl-2-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine is Cc1cccc(-c2cc3nc(C)cc(C)n3n2)c1.
What is the InChIKey of 5,7-dimethyl-2-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine?
The InChIKey is YWKHFVVLOQXGDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-10-5-4-6-13(7-10)14-9-15-16-11(2)8-12(3)18(15)17-14/h4-9H,1-3H3.
What are the key properties of 5,7-dimethyl-2-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine?
5,7-dimethyl-2-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine has a molecular weight of 237.31 g/mol, XLogP of 3.32, 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-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 819031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).