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

C17H16N2O2 — CID 882911

IUPAC[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methanol
SMILESCOc1ccc(-c2nn(-c3ccccc3)cc2CO)cc1
InChIInChI=1S/C17H16N2O2/c1-21-16-9-7-13(8-10-16)17-14(12-20)11-19(18-17)15-5-3-2-4-6-15/h2-11,20H,12H2,1H3
InChIKeyHRAFYYRYVAHBEW-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.04
Rot. Bonds4

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

[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methanol (PubChem CID 882911) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is [3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methanol.

Molecular Properties

Compound Name[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methanol
PubChem CID882911
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methanol
SMILESCOc1ccc(-c2nn(-c3ccccc3)cc2CO)cc1
InChIInChI=1S/C17H16N2O2/c1-21-16-9-7-13(8-10-16)17-14(12-20)11-19(18-17)15-5-3-2-4-6-15/h2-11,20H,12H2,1H3
InChIKeyHRAFYYRYVAHBEW-UHFFFAOYSA-N
XLogP3.04
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [3-(4-methoxyphenyl)-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

(3-(4-Methylphenyl)-1-phenyl-1H-pyrazol-4-YL)methanol
CID 752098
3-(4-methoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde
CID 792340
[1-benzyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]methanol
CID 2496576
(1S)-1-[(4aR,5S)-1-(4-fluorophenyl)-4a-methyl-1H,4H,4aH,5H,6H,7H,8H-cyclohexa[f]indazol-5-yl]-2-(4-methoxyphenyl)ethan-1-ol
CID 10002931
(R)-[(4aR,5S)-1-(4-fluorophenyl)-4a-methyl-1H,4H,4aH,5H,6H,7H,8H-cyclohexa[f]indazol-5-yl](4-fluoro-3-methoxyphenyl)methanol
CID 10478173
(R)-[(4aR,5S)-1-(4-fluorophenyl)-4a-methyl-1H,4H,4aH,5H,6H,7H,8H-cyclohexa[f]indazol-5-yl](3,4-difluoro-5-methoxyphenyl)methanol
CID 11305564
({1-[2-(4-methoxyphenyl)ethyl]-4-piperidinyl}methyl)methyl[(1-phenyl-1H-pyrazol-4-yl)methyl]amine
CID 26325235
3-(4-methoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime
CID 6894322
3-[(E)-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methylideneamino]-2-sulfanylidene-1,3-thiazolidin-4-one
CID 6890368
(3-(2,3-Dihydro-1,4-benzodioxin-6-YL)-1-phenyl-1H-pyrazol-4-YL)methanol
CID 2060907
1-[3-(2-fluoro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-N-(3-pyridinylmethyl)methanamine
CID 16189779
(1S)-1-[(4aR,5S)-1-(4-methoxyphenyl)-4a-methyl-5,6,7,8-tetrahydro-4H-benzo[f]indazol-5-yl]ethanol
CID 164621667

Frequently Asked Questions

What is the IUPAC name of [3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methanol?
The IUPAC name of [3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methanol (CID 882911) is [3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methanol.
What is the SMILES notation for [3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methanol?
The canonical SMILES for [3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methanol is COc1ccc(-c2nn(-c3ccccc3)cc2CO)cc1.
What is the InChIKey of [3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methanol?
The InChIKey is HRAFYYRYVAHBEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-21-16-9-7-13(8-10-16)17-14(12-20)11-19(18-17)15-5-3-2-4-6-15/h2-11,20H,12H2,1H3.
What are the key properties of [3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methanol?
[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methanol has a molecular weight of 280.33 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methanol is sourced from PubChem (CID 882911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).