(1,3-diphenylpyrazol-4-yl)methanol

C16H14N2O — CID 740175

IUPAC(1,3-diphenylpyrazol-4-yl)methanol
SMILESOCc1cn(-c2ccccc2)nc1-c1ccccc1
InChIInChI=1S/C16H14N2O/c19-12-14-11-18(15-9-5-2-6-10-15)17-16(14)13-7-3-1-4-8-13/h1-11,19H,12H2
InChIKeyRTJRIXAAKFEPLD-UHFFFAOYSA-N
MW250.30 g/mol
LogP3.03
Rot. Bonds3

About (1,3-diphenylpyrazol-4-yl)methanol

(1,3-diphenylpyrazol-4-yl)methanol (PubChem CID 740175) has the molecular formula C16H14N2O and a molecular weight of 250.30 g/mol. Its IUPAC name is (1,3-diphenylpyrazol-4-yl)methanol.

Molecular Properties

Compound Name(1,3-diphenylpyrazol-4-yl)methanol
PubChem CID740175
Molecular FormulaC16H14N2O
Molecular Weight250.30 g/mol
Exact Mass250.11
IUPAC Name(1,3-diphenylpyrazol-4-yl)methanol
SMILESOCc1cn(-c2ccccc2)nc1-c1ccccc1
InChIInChI=1S/C16H14N2O/c19-12-14-11-18(15-9-5-2-6-10-15)17-16(14)13-7-3-1-4-8-13/h1-11,19H,12H2
InChIKeyRTJRIXAAKFEPLD-UHFFFAOYSA-N
XLogP3.03
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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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
1,5-diphenyl-1H-pyrazole-4-carboxylic acid
CID 3801066
(R)-[(4aR,5S)-1-(4-fluorophenyl)-4a-methyl-1H,4H,4aH,5H,6H,7H-cyclopenta[f]indazol-5-yl](4-fluorophenyl)methanol
CID 10000582
(S)-[(4aR,5S)-1-(4-fluorophenyl)-4a-methyl-1H,4H,4aH,5H,6H,7H-cyclopenta[f]indazol-5-yl](4-fluorophenyl)methanol
CID 10453115
Glucocorticoids receptor agonist 2
CID 10475384
3-(4-Bromophenyl)-1-phenyl-1H-pyrazole-4-methanol
CID 740185
3-(1,3-Diphenyl-1h-pyrazol-4-yl)-acrylic acid
CID 706607
(1-methyl-5-phenyl-1H-pyrazol-4-yl)methanol
CID 2795476
1,3-diphenyl-1H-pyrazole-4-carboxylic acid
CID 847409
[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methanol
CID 740195
3-(4-methylphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime
CID 6894324

Frequently Asked Questions

What is the IUPAC name of (1,3-diphenylpyrazol-4-yl)methanol?
The IUPAC name of (1,3-diphenylpyrazol-4-yl)methanol (CID 740175) is (1,3-diphenylpyrazol-4-yl)methanol.
What is the SMILES notation for (1,3-diphenylpyrazol-4-yl)methanol?
The canonical SMILES for (1,3-diphenylpyrazol-4-yl)methanol is OCc1cn(-c2ccccc2)nc1-c1ccccc1.
What is the InChIKey of (1,3-diphenylpyrazol-4-yl)methanol?
The InChIKey is RTJRIXAAKFEPLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c19-12-14-11-18(15-9-5-2-6-10-15)17-16(14)13-7-3-1-4-8-13/h1-11,19H,12H2.
What are the key properties of (1,3-diphenylpyrazol-4-yl)methanol?
(1,3-diphenylpyrazol-4-yl)methanol has a molecular weight of 250.30 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1,3-diphenylpyrazol-4-yl)methanol is sourced from PubChem (CID 740175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).