3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol

C10H12N2O — CID 126661673

IUPAC3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol
SMILESCC1=CN(c2cccc(O)c2)NC1
InChIInChI=1S/C10H12N2O/c1-8-6-11-12(7-8)9-3-2-4-10(13)5-9/h2-5,7,11,13H,6H2,1H3
InChIKeyKJPSJIWCOQARKP-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.62
Rot. Bonds1

About 3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol

3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol (PubChem CID 126661673) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol.

Molecular Properties

Compound Name3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol
PubChem CID126661673
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol
SMILESCC1=CN(c2cccc(O)c2)NC1
InChIInChI=1S/C10H12N2O/c1-8-6-11-12(7-8)9-3-2-4-10(13)5-9/h2-5,7,11,13H,6H2,1H3
InChIKeyKJPSJIWCOQARKP-UHFFFAOYSA-N
XLogP1.62
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol 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 3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol?
The IUPAC name of 3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol (CID 126661673) is 3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol.
What is the SMILES notation for 3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol?
The canonical SMILES for 3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol is CC1=CN(c2cccc(O)c2)NC1.
What is the InChIKey of 3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol?
The InChIKey is KJPSJIWCOQARKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c1-8-6-11-12(7-8)9-3-2-4-10(13)5-9/h2-5,7,11,13H,6H2,1H3.
What are the key properties of 3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol?
3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol has a molecular weight of 176.22 g/mol, XLogP of 1.62, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methyl-1,5-dihydropyrazol-2-yl)phenol is sourced from PubChem (CID 126661673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).