[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol

C7H9F3N2O — CID 25247664

IUPAC[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol
SMILESCCn1nc(C(F)(F)F)cc1CO
InChIInChI=1S/C7H9F3N2O/c1-2-12-5(4-13)3-6(11-12)7(8,9)10/h3,13H,2,4H2,1H3
InChIKeyIFVAQADNEKAYHG-UHFFFAOYSA-N
MW194.16 g/mol
LogP1.41
Rot. Bonds2

About [1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol

[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol (PubChem CID 25247664) has the molecular formula C7H9F3N2O and a molecular weight of 194.16 g/mol. Its IUPAC name is [1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol.

Molecular Properties

Compound Name[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol
PubChem CID25247664
Molecular FormulaC7H9F3N2O
Molecular Weight194.16 g/mol
Exact Mass194.07
IUPAC Name[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol
SMILESCCn1nc(C(F)(F)F)cc1CO
InChIInChI=1S/C7H9F3N2O/c1-2-12-5(4-13)3-6(11-12)7(8,9)10/h3,13H,2,4H2,1H3
InChIKeyIFVAQADNEKAYHG-UHFFFAOYSA-N
XLogP1.41
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.16
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol 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-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol?
The IUPAC name of [1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol (CID 25247664) is [1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol.
What is the SMILES notation for [1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol?
The canonical SMILES for [1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol is CCn1nc(C(F)(F)F)cc1CO.
What is the InChIKey of [1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol?
The InChIKey is IFVAQADNEKAYHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9F3N2O/c1-2-12-5(4-13)3-6(11-12)7(8,9)10/h3,13H,2,4H2,1H3.
What are the key properties of [1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol?
[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol has a molecular weight of 194.16 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]methanol is sourced from PubChem (CID 25247664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).