[1-(2-fluorophenyl)-3-(methoxymethyl)pyrazol-4-yl]methanol

C12H13FN2O2 — CID 67167968

IUPAC[1-(2-fluorophenyl)-3-(methoxymethyl)pyrazol-4-yl]methanol
SMILESCOCc1nn(-c2ccccc2F)cc1CO
InChIInChI=1S/C12H13FN2O2/c1-17-8-11-9(7-16)6-15(14-11)12-5-3-2-4-10(12)13/h2-6,16H,7-8H2,1H3
InChIKeyHVELEPKPBXUIAZ-UHFFFAOYSA-N
MW236.25 g/mol
LogP1.65
Rot. Bonds4

About [1-(2-fluorophenyl)-3-(methoxymethyl)pyrazol-4-yl]methanol

[1-(2-fluorophenyl)-3-(methoxymethyl)pyrazol-4-yl]methanol (PubChem CID 67167968) has the molecular formula C12H13FN2O2 and a molecular weight of 236.25 g/mol. Its IUPAC name is [1-(2-fluorophenyl)-3-(methoxymethyl)pyrazol-4-yl]methanol.

Molecular Properties

Compound Name[1-(2-fluorophenyl)-3-(methoxymethyl)pyrazol-4-yl]methanol
PubChem CID67167968
Molecular FormulaC12H13FN2O2
Molecular Weight236.25 g/mol
Exact Mass236.10
IUPAC Name[1-(2-fluorophenyl)-3-(methoxymethyl)pyrazol-4-yl]methanol
SMILESCOCc1nn(-c2ccccc2F)cc1CO
InChIInChI=1S/C12H13FN2O2/c1-17-8-11-9(7-16)6-15(14-11)12-5-3-2-4-10(12)13/h2-6,16H,7-8H2,1H3
InChIKeyHVELEPKPBXUIAZ-UHFFFAOYSA-N
XLogP1.65
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.25
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [1-(2-fluorophenyl)-3-(methoxymethyl)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 [1-(2-fluorophenyl)-3-(methoxymethyl)pyrazol-4-yl]methanol?
The IUPAC name of [1-(2-fluorophenyl)-3-(methoxymethyl)pyrazol-4-yl]methanol (CID 67167968) is [1-(2-fluorophenyl)-3-(methoxymethyl)pyrazol-4-yl]methanol.
What is the SMILES notation for [1-(2-fluorophenyl)-3-(methoxymethyl)pyrazol-4-yl]methanol?
The canonical SMILES for [1-(2-fluorophenyl)-3-(methoxymethyl)pyrazol-4-yl]methanol is COCc1nn(-c2ccccc2F)cc1CO.
What is the InChIKey of [1-(2-fluorophenyl)-3-(methoxymethyl)pyrazol-4-yl]methanol?
The InChIKey is HVELEPKPBXUIAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN2O2/c1-17-8-11-9(7-16)6-15(14-11)12-5-3-2-4-10(12)13/h2-6,16H,7-8H2,1H3.
What are the key properties of [1-(2-fluorophenyl)-3-(methoxymethyl)pyrazol-4-yl]methanol?
[1-(2-fluorophenyl)-3-(methoxymethyl)pyrazol-4-yl]methanol has a molecular weight of 236.25 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluorophenyl)-3-(methoxymethyl)pyrazol-4-yl]methanol is sourced from PubChem (CID 67167968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).