2-(5-ethyl-1H-pyrazol-4-yl)ethanol

C7H12N2O — CID 83674438

IUPAC2-(5-ethyl-1H-pyrazol-4-yl)ethanol
SMILESCCc1[nH]ncc1CCO
InChIInChI=1S/C7H12N2O/c1-2-7-6(3-4-10)5-8-9-7/h5,10H,2-4H2,1H3,(H,8,9)
InChIKeyVJYZSUFVGHDSGO-UHFFFAOYSA-N
MW140.19 g/mol
LogP0.51
Rot. Bonds3

About 2-(5-ethyl-1H-pyrazol-4-yl)ethanol

2-(5-ethyl-1H-pyrazol-4-yl)ethanol (PubChem CID 83674438) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 2-(5-ethyl-1H-pyrazol-4-yl)ethanol.

Molecular Properties

Compound Name2-(5-ethyl-1H-pyrazol-4-yl)ethanol
PubChem CID83674438
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name2-(5-ethyl-1H-pyrazol-4-yl)ethanol
SMILESCCc1[nH]ncc1CCO
InChIInChI=1S/C7H12N2O/c1-2-7-6(3-4-10)5-8-9-7/h5,10H,2-4H2,1H3,(H,8,9)
InChIKeyVJYZSUFVGHDSGO-UHFFFAOYSA-N
XLogP0.51
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(5-ethyl-1H-pyrazol-4-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-(5-ethyl-1H-pyrazol-4-yl)ethanol?
The IUPAC name of 2-(5-ethyl-1H-pyrazol-4-yl)ethanol (CID 83674438) is 2-(5-ethyl-1H-pyrazol-4-yl)ethanol.
What is the SMILES notation for 2-(5-ethyl-1H-pyrazol-4-yl)ethanol?
The canonical SMILES for 2-(5-ethyl-1H-pyrazol-4-yl)ethanol is CCc1[nH]ncc1CCO.
What is the InChIKey of 2-(5-ethyl-1H-pyrazol-4-yl)ethanol?
The InChIKey is VJYZSUFVGHDSGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-2-7-6(3-4-10)5-8-9-7/h5,10H,2-4H2,1H3,(H,8,9).
What are the key properties of 2-(5-ethyl-1H-pyrazol-4-yl)ethanol?
2-(5-ethyl-1H-pyrazol-4-yl)ethanol has a molecular weight of 140.19 g/mol, XLogP of 0.51, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethyl-1H-pyrazol-4-yl)ethanol is sourced from PubChem (CID 83674438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).