1-phenyl-2-pyrazol-1-ylethanol

C11H12N2O — CID 3245641

IUPAC1-phenyl-2-pyrazol-1-ylethanol
SMILESOC(Cn1cccn1)c1ccccc1
InChIInChI=1S/C11H12N2O/c14-11(9-13-8-4-7-12-13)10-5-2-1-3-6-10/h1-8,11,14H,9H2
InChIKeyBAOSEPHEMSBKSA-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.62
Rot. Bonds3

About 1-phenyl-2-pyrazol-1-ylethanol

1-phenyl-2-pyrazol-1-ylethanol (PubChem CID 3245641) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 1-phenyl-2-pyrazol-1-ylethanol.

Molecular Properties

Compound Name1-phenyl-2-pyrazol-1-ylethanol
PubChem CID3245641
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name1-phenyl-2-pyrazol-1-ylethanol
SMILESOC(Cn1cccn1)c1ccccc1
InChIInChI=1S/C11H12N2O/c14-11(9-13-8-4-7-12-13)10-5-2-1-3-6-10/h1-8,11,14H,9H2
InChIKeyBAOSEPHEMSBKSA-UHFFFAOYSA-N
XLogP1.62
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1-methyl-5-phenyl-1H-pyrazol-4-yl)methanol
CID 2795476
(4-(1H-Pyrazol-1-yl)phenyl)methanol
CID 2776480
1-(4-Hydroxybenzyl)pyrazole
CID 133412
2-(3,5-Dimethyl-1H-pyrazol-1-yl)-1-(4-methylphenyl)ethan-1-ol
CID 3511640
2-[3-(3,5-Dimethyl-1-pyrazolyl)propylamino]-1-phenylethanol;oxalic acid
CID 2999795
2-[[1-(4-Bromo-1H-pyrazol-1-yl)propan-2-yl]amino]-1-(3-methylphenyl)ethan-1-ol
CID 75441596
3-(1H-Pyrazol-1-yl)benzyl alcohol
CID 7164580
4-(1H-Pyrazol-1-ylmethyl)benzenemethanol
CID 16640562
(1-Methyl-5-phenyl-1H-pyrazol-3-yl)methanol
CID 14354447
1-(2,4-Dimethylphenyl)-2-[4-[(1-ethylpyrazol-4-yl)methyl]piperazin-1-yl]ethanol
CID 46956904
1-(3,4-Dimethylphenyl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]ethanol
CID 48076344
2-[5-(Hydroxymethyl)-3-phenylpyrazol-1-yl]-1-phenylethanol
CID 50908372

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-pyrazol-1-ylethanol?
The IUPAC name of 1-phenyl-2-pyrazol-1-ylethanol (CID 3245641) is 1-phenyl-2-pyrazol-1-ylethanol.
What is the SMILES notation for 1-phenyl-2-pyrazol-1-ylethanol?
The canonical SMILES for 1-phenyl-2-pyrazol-1-ylethanol is OC(Cn1cccn1)c1ccccc1.
What is the InChIKey of 1-phenyl-2-pyrazol-1-ylethanol?
The InChIKey is BAOSEPHEMSBKSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c14-11(9-13-8-4-7-12-13)10-5-2-1-3-6-10/h1-8,11,14H,9H2.
What are the key properties of 1-phenyl-2-pyrazol-1-ylethanol?
1-phenyl-2-pyrazol-1-ylethanol has a molecular weight of 188.23 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-pyrazol-1-ylethanol is sourced from PubChem (CID 3245641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).