2-(2-phenylpyrazol-3-yl)ethanol

C11H12N2O — CID 59410573

IUPAC2-(2-phenylpyrazol-3-yl)ethanol
SMILESOCCc1ccnn1-c1ccccc1
InChIInChI=1S/C11H12N2O/c14-9-7-11-6-8-12-13(11)10-4-2-1-3-5-10/h1-6,8,14H,7,9H2
InChIKeySZQAPECSMHRYMF-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.41
Rot. Bonds3

About 2-(2-phenylpyrazol-3-yl)ethanol

2-(2-phenylpyrazol-3-yl)ethanol (PubChem CID 59410573) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 2-(2-phenylpyrazol-3-yl)ethanol.

Molecular Properties

Compound Name2-(2-phenylpyrazol-3-yl)ethanol
PubChem CID59410573
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name2-(2-phenylpyrazol-3-yl)ethanol
SMILESOCCc1ccnn1-c1ccccc1
InChIInChI=1S/C11H12N2O/c14-9-7-11-6-8-12-13(11)10-4-2-1-3-5-10/h1-6,8,14H,7,9H2
InChIKeySZQAPECSMHRYMF-UHFFFAOYSA-N
XLogP1.41
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 ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylpyrazol-3-yl)ethanol?
The IUPAC name of 2-(2-phenylpyrazol-3-yl)ethanol (CID 59410573) is 2-(2-phenylpyrazol-3-yl)ethanol.
What is the SMILES notation for 2-(2-phenylpyrazol-3-yl)ethanol?
The canonical SMILES for 2-(2-phenylpyrazol-3-yl)ethanol is OCCc1ccnn1-c1ccccc1.
What is the InChIKey of 2-(2-phenylpyrazol-3-yl)ethanol?
The InChIKey is SZQAPECSMHRYMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c14-9-7-11-6-8-12-13(11)10-4-2-1-3-5-10/h1-6,8,14H,7,9H2.
What are the key properties of 2-(2-phenylpyrazol-3-yl)ethanol?
2-(2-phenylpyrazol-3-yl)ethanol has a molecular weight of 188.23 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylpyrazol-3-yl)ethanol is sourced from PubChem (CID 59410573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).