1-[3-(4-methylpyrazol-1-yl)phenyl]ethanol

C12H14N2O — CID 117290920

IUPAC1-[3-(4-methylpyrazol-1-yl)phenyl]ethanol
SMILESCc1cnn(-c2cccc(C(C)O)c2)c1
InChIInChI=1S/C12H14N2O/c1-9-7-13-14(8-9)12-5-3-4-11(6-12)10(2)15/h3-8,10,15H,1-2H3
InChIKeyGAXCAMDJTUMTHF-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.23
Rot. Bonds2

About 1-[3-(4-methylpyrazol-1-yl)phenyl]ethanol

1-[3-(4-methylpyrazol-1-yl)phenyl]ethanol (PubChem CID 117290920) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 1-[3-(4-methylpyrazol-1-yl)phenyl]ethanol.

Molecular Properties

Compound Name1-[3-(4-methylpyrazol-1-yl)phenyl]ethanol
PubChem CID117290920
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name1-[3-(4-methylpyrazol-1-yl)phenyl]ethanol
SMILESCc1cnn(-c2cccc(C(C)O)c2)c1
InChIInChI=1S/C12H14N2O/c1-9-7-13-14(8-9)12-5-3-4-11(6-12)10(2)15/h3-8,10,15H,1-2H3
InChIKeyGAXCAMDJTUMTHF-UHFFFAOYSA-N
XLogP2.23
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(4-methylpyrazol-1-yl)phenyl]boronic acid
CID 86208031
2-amino-1-[1-(3-methylphenyl)pyrazol-4-yl]ethanol
CID 83887534
1-(3,4-dimethylphenyl)-4-methylpyrazole
CID 148851288
(1R)-1-[4-(4-methylpyrazol-1-yl)phenyl]ethanamine
CID 78937565
1-[3-(3,5-dimethylpyrazol-1-yl)phenyl]ethanol
CID 16640536
1-[3-(2-methylimidazol-1-yl)phenyl]ethanol
CID 117290921
2-amino-4-(4-methylpyrazol-1-yl)phenol
CID 84662036
1-(3-imidazol-1-ylphenyl)ethanol
CID 50973411
3-(4-methylpyrazol-1-yl)-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]propanamide
CID 95906003
3-(4-propan-2-ylpyrazol-1-yl)benzoic acid
CID 84793615
N-methyl-4-(4-methylpyrazol-1-yl)-N-[1-(3-nitrophenyl)ethyl]benzamide
CID 55773278
1-(4-chloro-3-fluorophenyl)-4-methylpyrazole
CID 79149054

Frequently Asked Questions

What is the IUPAC name of 1-[3-(4-methylpyrazol-1-yl)phenyl]ethanol?
The IUPAC name of 1-[3-(4-methylpyrazol-1-yl)phenyl]ethanol (CID 117290920) is 1-[3-(4-methylpyrazol-1-yl)phenyl]ethanol.
What is the SMILES notation for 1-[3-(4-methylpyrazol-1-yl)phenyl]ethanol?
The canonical SMILES for 1-[3-(4-methylpyrazol-1-yl)phenyl]ethanol is Cc1cnn(-c2cccc(C(C)O)c2)c1.
What is the InChIKey of 1-[3-(4-methylpyrazol-1-yl)phenyl]ethanol?
The InChIKey is GAXCAMDJTUMTHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-9-7-13-14(8-9)12-5-3-4-11(6-12)10(2)15/h3-8,10,15H,1-2H3.
What are the key properties of 1-[3-(4-methylpyrazol-1-yl)phenyl]ethanol?
1-[3-(4-methylpyrazol-1-yl)phenyl]ethanol has a molecular weight of 202.26 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(4-methylpyrazol-1-yl)phenyl]ethanol is sourced from PubChem (CID 117290920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).