1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol

C15H20N2O — CID 64770812

IUPAC1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
SMILESCc1ccccc1C(O)Cc1ccn(C(C)C)n1
InChIInChI=1S/C15H20N2O/c1-11(2)17-9-8-13(16-17)10-15(18)14-7-5-4-6-12(14)3/h4-9,11,15,18H,10H2,1-3H3
InChIKeyMWLNPEQVABIXQB-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.05
Rot. Bonds4

About 1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol

1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol (PubChem CID 64770812) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol.

Molecular Properties

Compound Name1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
PubChem CID64770812
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
SMILESCc1ccccc1C(O)Cc1ccn(C(C)C)n1
InChIInChI=1S/C15H20N2O/c1-11(2)17-9-8-13(16-17)10-15(18)14-7-5-4-6-12(14)3/h4-9,11,15,18H,10H2,1-3H3
InChIKeyMWLNPEQVABIXQB-UHFFFAOYSA-N
XLogP3.05
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
CID 64771004
3-methyl-4-(1-propan-2-ylpyrazol-3-yl)butan-2-ol
CID 64772656
[1-(2-fluoro-3-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
CID 105312794
1-(2-bromo-3-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanamine
CID 107985060
1-(1,5-dimethylpyrazol-3-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
CID 114220139
2-(1-propan-2-ylpyrazol-3-yl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol
CID 105103448
1-(5-bromo-2-fluorophenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
CID 64771163
1-(2-fluorophenyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol
CID 64783495
1-(2-methylpyrimidin-4-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
CID 115527999
1-(3-chlorophenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
CID 64772954
2-(1-butan-2-ylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)ethanol
CID 64785243
2-[(1-propan-2-ylpyrazol-3-yl)methyl]propane-1,3-diol
CID 79449988

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol?
The IUPAC name of 1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol (CID 64770812) is 1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol.
What is the SMILES notation for 1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol?
The canonical SMILES for 1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol is Cc1ccccc1C(O)Cc1ccn(C(C)C)n1.
What is the InChIKey of 1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol?
The InChIKey is MWLNPEQVABIXQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-11(2)17-9-8-13(16-17)10-15(18)14-7-5-4-6-12(14)3/h4-9,11,15,18H,10H2,1-3H3.
What are the key properties of 1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol?
1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol has a molecular weight of 244.34 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol is sourced from PubChem (CID 64770812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).