[5-(difluoromethyl)-1-propan-2-ylpyrazol-4-yl]methanol

C8H12F2N2O — CID 66436590

IUPAC[5-(difluoromethyl)-1-propan-2-ylpyrazol-4-yl]methanol
SMILESCC(C)n1ncc(CO)c1C(F)F
InChIInChI=1S/C8H12F2N2O/c1-5(2)12-7(8(9)10)6(4-13)3-11-12/h3,5,8,13H,4H2,1-2H3
InChIKeyWVFZLZNUSITYQH-UHFFFAOYSA-N
MW190.19 g/mol
LogP1.89
Rot. Bonds3

About [5-(difluoromethyl)-1-propan-2-ylpyrazol-4-yl]methanol

[5-(difluoromethyl)-1-propan-2-ylpyrazol-4-yl]methanol (PubChem CID 66436590) has the molecular formula C8H12F2N2O and a molecular weight of 190.19 g/mol. Its IUPAC name is [5-(difluoromethyl)-1-propan-2-ylpyrazol-4-yl]methanol.

Molecular Properties

Compound Name[5-(difluoromethyl)-1-propan-2-ylpyrazol-4-yl]methanol
PubChem CID66436590
Molecular FormulaC8H12F2N2O
Molecular Weight190.19 g/mol
Exact Mass190.09
IUPAC Name[5-(difluoromethyl)-1-propan-2-ylpyrazol-4-yl]methanol
SMILESCC(C)n1ncc(CO)c1C(F)F
InChIInChI=1S/C8H12F2N2O/c1-5(2)12-7(8(9)10)6(4-13)3-11-12/h3,5,8,13H,4H2,1-2H3
InChIKeyWVFZLZNUSITYQH-UHFFFAOYSA-N
XLogP1.89
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.19
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [5-(difluoromethyl)-1-propan-2-ylpyrazol-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

Related Compounds

(5-cyclopropyl-1-propan-2-ylpyrazol-4-yl)methanol
CID 66436592
[1,5-di(propan-2-yl)pyrazol-4-yl]methanamine
CID 66440927
[1-cycloheptyl-5-(difluoromethyl)pyrazol-4-yl]methanol
CID 66438121
4-(chloromethyl)-5-(difluoromethyl)-1-pentan-3-ylpyrazole
CID 66439255
[5-(difluoromethyl)-1-(3-methylphenyl)pyrazol-4-yl]methanol
CID 66436584
(5-fluoro-1-propan-2-ylpyrazol-4-yl)methanamine
CID 115012224
2-(4-bromo-1-propan-2-ylpyrazol-5-yl)-2-fluoroethanamine
CID 114667634
1-[1,5-di(propan-2-yl)pyrazol-4-yl]-N-methylpropan-2-amine
CID 105481338
[5-propan-2-yl-1-(3,4,5-trifluorophenyl)pyrazol-4-yl]methanol
CID 79200265
4-(difluoromethoxy)-1,5-di(propan-2-yl)pyrazole
CID 162378326
4-(aminomethyl)-1-propan-2-ylpyrazol-5-amine
CID 115069507
1-butan-2-yl-5-(difluoromethyl)pyrazol-4-amine
CID 66441034

Frequently Asked Questions

What is the IUPAC name of [5-(difluoromethyl)-1-propan-2-ylpyrazol-4-yl]methanol?
The IUPAC name of [5-(difluoromethyl)-1-propan-2-ylpyrazol-4-yl]methanol (CID 66436590) is [5-(difluoromethyl)-1-propan-2-ylpyrazol-4-yl]methanol.
What is the SMILES notation for [5-(difluoromethyl)-1-propan-2-ylpyrazol-4-yl]methanol?
The canonical SMILES for [5-(difluoromethyl)-1-propan-2-ylpyrazol-4-yl]methanol is CC(C)n1ncc(CO)c1C(F)F.
What is the InChIKey of [5-(difluoromethyl)-1-propan-2-ylpyrazol-4-yl]methanol?
The InChIKey is WVFZLZNUSITYQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F2N2O/c1-5(2)12-7(8(9)10)6(4-13)3-11-12/h3,5,8,13H,4H2,1-2H3.
What are the key properties of [5-(difluoromethyl)-1-propan-2-ylpyrazol-4-yl]methanol?
[5-(difluoromethyl)-1-propan-2-ylpyrazol-4-yl]methanol has a molecular weight of 190.19 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(difluoromethyl)-1-propan-2-ylpyrazol-4-yl]methanol is sourced from PubChem (CID 66436590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).