[1-(4-methylphenyl)-3-phenylpyrazol-4-yl]methanol

C17H16N2O — CID 3859567

IUPAC[1-(4-methylphenyl)-3-phenylpyrazol-4-yl]methanol
SMILESCc1ccc(-n2cc(CO)c(-c3ccccc3)n2)cc1
InChIInChI=1S/C17H16N2O/c1-13-7-9-16(10-8-13)19-11-15(12-20)17(18-19)14-5-3-2-4-6-14/h2-11,20H,12H2,1H3
InChIKeyIXGOWCOSYJKTFT-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.34
Rot. Bonds3

About [1-(4-methylphenyl)-3-phenylpyrazol-4-yl]methanol

[1-(4-methylphenyl)-3-phenylpyrazol-4-yl]methanol (PubChem CID 3859567) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is [1-(4-methylphenyl)-3-phenylpyrazol-4-yl]methanol.

Molecular Properties

Compound Name[1-(4-methylphenyl)-3-phenylpyrazol-4-yl]methanol
PubChem CID3859567
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name[1-(4-methylphenyl)-3-phenylpyrazol-4-yl]methanol
SMILESCc1ccc(-n2cc(CO)c(-c3ccccc3)n2)cc1
InChIInChI=1S/C17H16N2O/c1-13-7-9-16(10-8-13)19-11-15(12-20)17(18-19)14-5-3-2-4-6-14/h2-11,20H,12H2,1H3
InChIKeyIXGOWCOSYJKTFT-UHFFFAOYSA-N
XLogP3.34
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(4-methylphenyl)-3-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

(3-(4-Methylphenyl)-1-phenyl-1H-pyrazol-4-YL)methanol
CID 752098
[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methanol
CID 882911
(R)-[(4aR,5S)-1-(4-fluorophenyl)-4a-methyl-1H,4H,4aH,5H,6H,7H-cyclopenta[f]indazol-5-yl](4-fluorophenyl)methanol
CID 10000582
(R)-[(4aR,5S)-1-(4-fluorophenyl)-4a-methyl-1H,4H,4aH,5H,6H,7H,8H-cyclohexa[f]indazol-5-yl](2-fluorophenyl)methanol
CID 10046928
(S)-[(4aR,5S)-1-(4-fluorophenyl)-4a-methyl-1H,4H,4aH,5H,6H,7H-cyclopenta[f]indazol-5-yl](4-fluorophenyl)methanol
CID 10453115
(R)-[(4aR,5S)-1-(4-fluorophenyl)-4a-methyl-1H,4H,4aH,5H,6H,7H,8H-cyclohexa[f]indazol-5-yl](4-fluorophenyl)methanol
CID 10454007
Glucocorticoids receptor agonist 2
CID 10475384
(S)-[(4aR,5S)-1-(4-fluorophenyl)-4a-methyl-1H,4H,4aH,5H,6H,7H,8H-cyclohexa[f]indazol-5-yl](4-fluorophenyl)methanol
CID 11429662
3-(4-Bromophenyl)-1-phenyl-1H-pyrazole-4-methanol
CID 740185
(1-methyl-5-phenyl-1H-pyrazol-4-yl)methanol
CID 2795476
1-(4-methylphenyl)-3-phenyl-1H-pyrazole-4-carboxylic acid
CID 2513400
1,5-Diphenyl-3-(2-hydroxyethyl)-4-ethylpyrazole
CID 5327639

Frequently Asked Questions

What is the IUPAC name of [1-(4-methylphenyl)-3-phenylpyrazol-4-yl]methanol?
The IUPAC name of [1-(4-methylphenyl)-3-phenylpyrazol-4-yl]methanol (CID 3859567) is [1-(4-methylphenyl)-3-phenylpyrazol-4-yl]methanol.
What is the SMILES notation for [1-(4-methylphenyl)-3-phenylpyrazol-4-yl]methanol?
The canonical SMILES for [1-(4-methylphenyl)-3-phenylpyrazol-4-yl]methanol is Cc1ccc(-n2cc(CO)c(-c3ccccc3)n2)cc1.
What is the InChIKey of [1-(4-methylphenyl)-3-phenylpyrazol-4-yl]methanol?
The InChIKey is IXGOWCOSYJKTFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-13-7-9-16(10-8-13)19-11-15(12-20)17(18-19)14-5-3-2-4-6-14/h2-11,20H,12H2,1H3.
What are the key properties of [1-(4-methylphenyl)-3-phenylpyrazol-4-yl]methanol?
[1-(4-methylphenyl)-3-phenylpyrazol-4-yl]methanol has a molecular weight of 264.33 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methylphenyl)-3-phenylpyrazol-4-yl]methanol is sourced from PubChem (CID 3859567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).