(3,5-dimethyl-1-phenylpyrazol-4-yl)methanol

C12H14N2O — CID 2526674

IUPAC(3,5-dimethyl-1-phenylpyrazol-4-yl)methanol
SMILESCc1nn(-c2ccccc2)c(C)c1CO
InChIInChI=1S/C12H14N2O/c1-9-12(8-15)10(2)14(13-9)11-6-4-3-5-7-11/h3-7,15H,8H2,1-2H3
InChIKeyJMWWSNPRAOYPSF-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.98
Rot. Bonds2

About (3,5-dimethyl-1-phenylpyrazol-4-yl)methanol

(3,5-dimethyl-1-phenylpyrazol-4-yl)methanol (PubChem CID 2526674) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is (3,5-dimethyl-1-phenylpyrazol-4-yl)methanol.

Molecular Properties

Compound Name(3,5-dimethyl-1-phenylpyrazol-4-yl)methanol
PubChem CID2526674
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name(3,5-dimethyl-1-phenylpyrazol-4-yl)methanol
SMILESCc1nn(-c2ccccc2)c(C)c1CO
InChIInChI=1S/C12H14N2O/c1-9-12(8-15)10(2)14(13-9)11-6-4-3-5-7-11/h3-7,15H,8H2,1-2H3
InChIKeyJMWWSNPRAOYPSF-UHFFFAOYSA-N
XLogP1.98
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3,5-dimethyl-1-phenylpyrazol-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

[1-(4-tert-butylphenyl)-3,5-dimethylpyrazol-4-yl]methanol
CID 39359841
2-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methylamino]ethanol
CID 43406566
3-(3,5-dimethyl-1-phenylpyrazol-4-yl)propanoic acid
CID 783981
3-(3,5-dimethyl-1-phenylpyrazol-4-yl)propan-1-amine
CID 79220501
(5-ethylsulfanyl-3-methyl-1-phenylpyrazol-4-yl)methanol
CID 63814567
[5-[ethyl(methyl)amino]-3-methyl-1-phenylpyrazol-4-yl]methanol
CID 43263588
4-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]phenol
CID 1478286
[3,5-dimethyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methanol
CID 39369333
2-[4-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]piperazin-1-yl]ethanol
CID 110880028
5-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methylamino]pentan-1-ol
CID 107303026
(3-methyl-1-phenyl-5-propylsulfanylpyrazol-4-yl)methanol
CID 15252513
[3-methyl-5-[methyl(3-methylbutan-2-yl)amino]-1-phenylpyrazol-4-yl]methanol
CID 43570330

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethyl-1-phenylpyrazol-4-yl)methanol?
The IUPAC name of (3,5-dimethyl-1-phenylpyrazol-4-yl)methanol (CID 2526674) is (3,5-dimethyl-1-phenylpyrazol-4-yl)methanol.
What is the SMILES notation for (3,5-dimethyl-1-phenylpyrazol-4-yl)methanol?
The canonical SMILES for (3,5-dimethyl-1-phenylpyrazol-4-yl)methanol is Cc1nn(-c2ccccc2)c(C)c1CO.
What is the InChIKey of (3,5-dimethyl-1-phenylpyrazol-4-yl)methanol?
The InChIKey is JMWWSNPRAOYPSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-9-12(8-15)10(2)14(13-9)11-6-4-3-5-7-11/h3-7,15H,8H2,1-2H3.
What are the key properties of (3,5-dimethyl-1-phenylpyrazol-4-yl)methanol?
(3,5-dimethyl-1-phenylpyrazol-4-yl)methanol has a molecular weight of 202.26 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethyl-1-phenylpyrazol-4-yl)methanol is sourced from PubChem (CID 2526674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).