1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine

C7H8F3N3 — CID 126971873

IUPAC1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine
SMILESNc1cnn(C2CC2)c1C(F)(F)F
InChIInChI=1S/C7H8F3N3/c8-7(9,10)6-5(11)3-12-13(6)4-1-2-4/h3-4H,1-2,11H2
InChIKeyHASAFZJRFXTMTG-UHFFFAOYSA-N
MW191.16 g/mol
LogP1.82
Rot. Bonds1

About 1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine

1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine (PubChem CID 126971873) has the molecular formula C7H8F3N3 and a molecular weight of 191.16 g/mol. Its IUPAC name is 1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine.

Molecular Properties

Compound Name1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine
PubChem CID126971873
Molecular FormulaC7H8F3N3
Molecular Weight191.16 g/mol
Exact Mass191.07
IUPAC Name1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine
SMILESNc1cnn(C2CC2)c1C(F)(F)F
InChIInChI=1S/C7H8F3N3/c8-7(9,10)6-5(11)3-12-13(6)4-1-2-4/h3-4H,1-2,11H2
InChIKeyHASAFZJRFXTMTG-UHFFFAOYSA-N
XLogP1.82
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.16
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine 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 1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine?
The IUPAC name of 1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine (CID 126971873) is 1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine.
What is the SMILES notation for 1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine?
The canonical SMILES for 1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine is Nc1cnn(C2CC2)c1C(F)(F)F.
What is the InChIKey of 1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine?
The InChIKey is HASAFZJRFXTMTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F3N3/c8-7(9,10)6-5(11)3-12-13(6)4-1-2-4/h3-4H,1-2,11H2.
What are the key properties of 1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine?
1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine has a molecular weight of 191.16 g/mol, XLogP of 1.82, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-amine is sourced from PubChem (CID 126971873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).