2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol

C14H14N4O — CID 72924283

IUPAC2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol
SMILESOCCn1cc(-c2ccc(-c3ccn[nH]3)cc2)cn1
InChIInChI=1S/C14H14N4O/c19-8-7-18-10-13(9-16-18)11-1-3-12(4-2-11)14-5-6-15-17-14/h1-6,9-10,19H,7-8H2,(H,15,17)
InChIKeyVSIUEHMMNHMBLD-UHFFFAOYSA-N
MW254.29 g/mol
LogP1.93
Rot. Bonds4

About 2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol

2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol (PubChem CID 72924283) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is 2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol
PubChem CID72924283
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol
SMILESOCCn1cc(-c2ccc(-c3ccn[nH]3)cc2)cn1
InChIInChI=1S/C14H14N4O/c19-8-7-18-10-13(9-16-18)11-1-3-12(4-2-11)14-5-6-15-17-14/h1-6,9-10,19H,7-8H2,(H,15,17)
InChIKeyVSIUEHMMNHMBLD-UHFFFAOYSA-N
XLogP1.93
TPSA66.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol?
The IUPAC name of 2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol (CID 72924283) is 2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol.
What is the SMILES notation for 2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol?
The canonical SMILES for 2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol is OCCn1cc(-c2ccc(-c3ccn[nH]3)cc2)cn1.
What is the InChIKey of 2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol?
The InChIKey is VSIUEHMMNHMBLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O/c19-8-7-18-10-13(9-16-18)11-1-3-12(4-2-11)14-5-6-15-17-14/h1-6,9-10,19H,7-8H2,(H,15,17).
What are the key properties of 2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol?
2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol has a molecular weight of 254.29 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-(1H-pyrazol-5-yl)phenyl]pyrazol-1-yl]ethanol is sourced from PubChem (CID 72924283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).