(1-phenylpyrazol-4-yl)methanol

C10H10N2O — CID 822983

IUPAC(1-phenylpyrazol-4-yl)methanol
SMILESOCc1cnn(-c2ccccc2)c1
InChIInChI=1S/C10H10N2O/c13-8-9-6-11-12(7-9)10-4-2-1-3-5-10/h1-7,13H,8H2
InChIKeyUCPVQFRIXFGLOJ-UHFFFAOYSA-N
MW174.20 g/mol
LogP1.36
Rot. Bonds2

About (1-phenylpyrazol-4-yl)methanol

(1-phenylpyrazol-4-yl)methanol (PubChem CID 822983) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is (1-phenylpyrazol-4-yl)methanol.

Molecular Properties

Compound Name(1-phenylpyrazol-4-yl)methanol
PubChem CID822983
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name(1-phenylpyrazol-4-yl)methanol
SMILESOCc1cnn(-c2ccccc2)c1
InChIInChI=1S/C10H10N2O/c13-8-9-6-11-12(7-9)10-4-2-1-3-5-10/h1-7,13H,8H2
InChIKeyUCPVQFRIXFGLOJ-UHFFFAOYSA-N
XLogP1.36
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-1H-pyrazole-4-carboxylic acid
CID 121026
(3-(4-Methylphenyl)-1-phenyl-1H-pyrazol-4-YL)methanol
CID 752098
(2E)-3-(1-phenyl-1H-pyrazol-4-yl)prop-2-enoic acid
CID 7130993
1-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid
CID 3159617
1-Phenylpyrazole
CID 70769
methyl((1-phenyl-1H-pyrazol-4-yl)methyl)amine
CID 7131170
1-Phenyl-1H-pyrazole-4-carbaldehyde
CID 952089
(4-(1H-Pyrazol-1-yl)phenyl)methanol
CID 2776480
2-(1-phenyl-1H-pyrazol-4-yl)ethan-1-amine
CID 6484139
2-(1-phenyl-1H-pyrazol-5-yl)ethan-1-ol
CID 59410573
5-Methyl-1-phenyl-1H-pyrazole-4-methanol
CID 2776440
[1-(4-Fluorophenyl)-5-Methyl-1H-Pyrazol-4-Yl]Methanol
CID 2780717

Frequently Asked Questions

What is the IUPAC name of (1-phenylpyrazol-4-yl)methanol?
The IUPAC name of (1-phenylpyrazol-4-yl)methanol (CID 822983) is (1-phenylpyrazol-4-yl)methanol.
What is the SMILES notation for (1-phenylpyrazol-4-yl)methanol?
The canonical SMILES for (1-phenylpyrazol-4-yl)methanol is OCc1cnn(-c2ccccc2)c1.
What is the InChIKey of (1-phenylpyrazol-4-yl)methanol?
The InChIKey is UCPVQFRIXFGLOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c13-8-9-6-11-12(7-9)10-4-2-1-3-5-10/h1-7,13H,8H2.
What are the key properties of (1-phenylpyrazol-4-yl)methanol?
(1-phenylpyrazol-4-yl)methanol has a molecular weight of 174.20 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-phenylpyrazol-4-yl)methanol is sourced from PubChem (CID 822983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).