3,5-dicyclopropyl-1-(difluoromethyl)pyrazole

C10H12F2N2 — CID 121211996

IUPAC3,5-dicyclopropyl-1-(difluoromethyl)pyrazole
SMILESFC(F)n1nc(C2CC2)cc1C1CC1
InChIInChI=1S/C10H12F2N2/c11-10(12)14-9(7-3-4-7)5-8(13-14)6-1-2-6/h5-7,10H,1-4H2
InChIKeyCBLCZXNUYYWBNX-UHFFFAOYSA-N
MW198.22 g/mol
LogP3.03
Rot. Bonds3

About 3,5-dicyclopropyl-1-(difluoromethyl)pyrazole

3,5-dicyclopropyl-1-(difluoromethyl)pyrazole (PubChem CID 121211996) has the molecular formula C10H12F2N2 and a molecular weight of 198.22 g/mol. Its IUPAC name is 3,5-dicyclopropyl-1-(difluoromethyl)pyrazole.

Molecular Properties

Compound Name3,5-dicyclopropyl-1-(difluoromethyl)pyrazole
PubChem CID121211996
Molecular FormulaC10H12F2N2
Molecular Weight198.22 g/mol
Exact Mass198.10
IUPAC Name3,5-dicyclopropyl-1-(difluoromethyl)pyrazole
SMILESFC(F)n1nc(C2CC2)cc1C1CC1
InChIInChI=1S/C10H12F2N2/c11-10(12)14-9(7-3-4-7)5-8(13-14)6-1-2-6/h5-7,10H,1-4H2
InChIKeyCBLCZXNUYYWBNX-UHFFFAOYSA-N
XLogP3.03
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-dicyclopropyl-1-(difluoromethyl)pyrazole?
The IUPAC name of 3,5-dicyclopropyl-1-(difluoromethyl)pyrazole (CID 121211996) is 3,5-dicyclopropyl-1-(difluoromethyl)pyrazole.
What is the SMILES notation for 3,5-dicyclopropyl-1-(difluoromethyl)pyrazole?
The canonical SMILES for 3,5-dicyclopropyl-1-(difluoromethyl)pyrazole is FC(F)n1nc(C2CC2)cc1C1CC1.
What is the InChIKey of 3,5-dicyclopropyl-1-(difluoromethyl)pyrazole?
The InChIKey is CBLCZXNUYYWBNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2N2/c11-10(12)14-9(7-3-4-7)5-8(13-14)6-1-2-6/h5-7,10H,1-4H2.
What are the key properties of 3,5-dicyclopropyl-1-(difluoromethyl)pyrazole?
3,5-dicyclopropyl-1-(difluoromethyl)pyrazole has a molecular weight of 198.22 g/mol, XLogP of 3.03, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dicyclopropyl-1-(difluoromethyl)pyrazole is sourced from PubChem (CID 121211996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).