5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole

C9H11F3N2 — CID 57071741

IUPAC5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole
SMILESFC(F)(F)c1cc(C2CCCC2)[nH]n1
InChIInChI=1S/C9H11F3N2/c10-9(11,12)8-5-7(13-14-8)6-3-1-2-4-6/h5-6H,1-4H2,(H,13,14)
InChIKeyIUVMQUBKMCQVPQ-UHFFFAOYSA-N
MW204.19 g/mol
LogP3.09
Rot. Bonds1

About 5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole

5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole (PubChem CID 57071741) has the molecular formula C9H11F3N2 and a molecular weight of 204.19 g/mol. Its IUPAC name is 5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole.

Molecular Properties

Compound Name5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole
PubChem CID57071741
Molecular FormulaC9H11F3N2
Molecular Weight204.19 g/mol
Exact Mass204.09
IUPAC Name5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole
SMILESFC(F)(F)c1cc(C2CCCC2)[nH]n1
InChIInChI=1S/C9H11F3N2/c10-9(11,12)8-5-7(13-14-8)6-3-1-2-4-6/h5-6H,1-4H2,(H,13,14)
InChIKeyIUVMQUBKMCQVPQ-UHFFFAOYSA-N
XLogP3.09
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.19
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole 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-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole?
The IUPAC name of 5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole (CID 57071741) is 5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole.
What is the SMILES notation for 5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole?
The canonical SMILES for 5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole is FC(F)(F)c1cc(C2CCCC2)[nH]n1.
What is the InChIKey of 5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole?
The InChIKey is IUVMQUBKMCQVPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F3N2/c10-9(11,12)8-5-7(13-14-8)6-3-1-2-4-6/h5-6H,1-4H2,(H,13,14).
What are the key properties of 5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole?
5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole has a molecular weight of 204.19 g/mol, XLogP of 3.09, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazole is sourced from PubChem (CID 57071741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).