5-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[1,5-a]pyrimidine

C11H11F2N3 — CID 843842

IUPAC5-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[1,5-a]pyrimidine
SMILESCc1cc2nc(C3CC3)cc(C(F)F)n2n1
InChIInChI=1S/C11H11F2N3/c1-6-4-10-14-8(7-2-3-7)5-9(11(12)13)16(10)15-6/h4-5,7,11H,2-3H2,1H3
InChIKeyKCSDOFXGVJPCCL-UHFFFAOYSA-N
MW223.23 g/mol
LogP2.85
Rot. Bonds2

About 5-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[1,5-a]pyrimidine

5-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[1,5-a]pyrimidine (PubChem CID 843842) has the molecular formula C11H11F2N3 and a molecular weight of 223.23 g/mol. Its IUPAC name is 5-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name5-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[1,5-a]pyrimidine
PubChem CID843842
Molecular FormulaC11H11F2N3
Molecular Weight223.23 g/mol
Exact Mass223.09
IUPAC Name5-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[1,5-a]pyrimidine
SMILESCc1cc2nc(C3CC3)cc(C(F)F)n2n1
InChIInChI=1S/C11H11F2N3/c1-6-4-10-14-8(7-2-3-7)5-9(11(12)13)16(10)15-6/h4-5,7,11H,2-3H2,1H3
InChIKeyKCSDOFXGVJPCCL-UHFFFAOYSA-N
XLogP2.85
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[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-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 5-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[1,5-a]pyrimidine (CID 843842) is 5-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 5-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 5-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[1,5-a]pyrimidine is Cc1cc2nc(C3CC3)cc(C(F)F)n2n1.
What is the InChIKey of 5-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[1,5-a]pyrimidine?
The InChIKey is KCSDOFXGVJPCCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F2N3/c1-6-4-10-14-8(7-2-3-7)5-9(11(12)13)16(10)15-6/h4-5,7,11H,2-3H2,1H3.
What are the key properties of 5-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[1,5-a]pyrimidine?
5-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[1,5-a]pyrimidine has a molecular weight of 223.23 g/mol, XLogP of 2.85, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-7-(difluoromethyl)-2-methylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 843842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).