[5-(difluoromethyl)-1H-pyrazol-4-yl]methanol

C5H6F2N2O — CID 66442625

IUPAC[5-(difluoromethyl)-1H-pyrazol-4-yl]methanol
SMILESOCc1cn[nH]c1C(F)F
InChIInChI=1S/C5H6F2N2O/c6-5(7)4-3(2-10)1-8-9-4/h1,5,10H,2H2,(H,8,9)
InChIKeyWIURGKAIBNGAEY-UHFFFAOYSA-N
MW148.11 g/mol
LogP0.84
Rot. Bonds2

About [5-(difluoromethyl)-1H-pyrazol-4-yl]methanol

[5-(difluoromethyl)-1H-pyrazol-4-yl]methanol (PubChem CID 66442625) has the molecular formula C5H6F2N2O and a molecular weight of 148.11 g/mol. Its IUPAC name is [5-(difluoromethyl)-1H-pyrazol-4-yl]methanol.

Molecular Properties

Compound Name[5-(difluoromethyl)-1H-pyrazol-4-yl]methanol
PubChem CID66442625
Molecular FormulaC5H6F2N2O
Molecular Weight148.11 g/mol
Exact Mass148.04
IUPAC Name[5-(difluoromethyl)-1H-pyrazol-4-yl]methanol
SMILESOCc1cn[nH]c1C(F)F
InChIInChI=1S/C5H6F2N2O/c6-5(7)4-3(2-10)1-8-9-4/h1,5,10H,2H2,(H,8,9)
InChIKeyWIURGKAIBNGAEY-UHFFFAOYSA-N
XLogP0.84
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.11
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [5-(difluoromethyl)-1H-pyrazol-4-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 [5-(difluoromethyl)-1H-pyrazol-4-yl]methanol?
The IUPAC name of [5-(difluoromethyl)-1H-pyrazol-4-yl]methanol (CID 66442625) is [5-(difluoromethyl)-1H-pyrazol-4-yl]methanol.
What is the SMILES notation for [5-(difluoromethyl)-1H-pyrazol-4-yl]methanol?
The canonical SMILES for [5-(difluoromethyl)-1H-pyrazol-4-yl]methanol is OCc1cn[nH]c1C(F)F.
What is the InChIKey of [5-(difluoromethyl)-1H-pyrazol-4-yl]methanol?
The InChIKey is WIURGKAIBNGAEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6F2N2O/c6-5(7)4-3(2-10)1-8-9-4/h1,5,10H,2H2,(H,8,9).
What are the key properties of [5-(difluoromethyl)-1H-pyrazol-4-yl]methanol?
[5-(difluoromethyl)-1H-pyrazol-4-yl]methanol has a molecular weight of 148.11 g/mol, XLogP of 0.84, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(difluoromethyl)-1H-pyrazol-4-yl]methanol is sourced from PubChem (CID 66442625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).