2-[(4-ethylphenyl)methyl]-2,3-dimethylbutan-1-ol

C15H24O — CID 83150614

IUPAC2-[(4-ethylphenyl)methyl]-2,3-dimethylbutan-1-ol
SMILESCCc1ccc(CC(C)(CO)C(C)C)cc1
InChIInChI=1S/C15H24O/c1-5-13-6-8-14(9-7-13)10-15(4,11-16)12(2)3/h6-9,12,16H,5,10-11H2,1-4H3
InChIKeyUZVBPTAFXDCKDX-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.45
Rot. Bonds5

About 2-[(4-ethylphenyl)methyl]-2,3-dimethylbutan-1-ol

2-[(4-ethylphenyl)methyl]-2,3-dimethylbutan-1-ol (PubChem CID 83150614) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 2-[(4-ethylphenyl)methyl]-2,3-dimethylbutan-1-ol.

Molecular Properties

Compound Name2-[(4-ethylphenyl)methyl]-2,3-dimethylbutan-1-ol
PubChem CID83150614
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name2-[(4-ethylphenyl)methyl]-2,3-dimethylbutan-1-ol
SMILESCCc1ccc(CC(C)(CO)C(C)C)cc1
InChIInChI=1S/C15H24O/c1-5-13-6-8-14(9-7-13)10-15(4,11-16)12(2)3/h6-9,12,16H,5,10-11H2,1-4H3
InChIKeyUZVBPTAFXDCKDX-UHFFFAOYSA-N
XLogP3.45
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(4-fluorophenyl)methyl]-2,3-dimethylbutan-1-ol
CID 83151720
3-(4-ethylphenyl)-2,2-dimethylpropan-1-ol
CID 21254615
2-[(4-ethylphenyl)methyl]-2,3-dimethyl-N-(2-methylpropyl)butan-1-amine
CID 83151559
2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol
CID 83150043
2-[(4-chloro-3-fluorophenyl)methyl]-2,3-dimethylbutan-1-ol
CID 107895015
2-[(4-ethylphenyl)methyl]-N-(2-methoxyethyl)-2,3-dimethylbutan-1-amine
CID 83150266
2-amino-2-(4-ethylphenyl)propan-1-ol
CID 61054820
1-chloro-4-[2-(chloromethyl)-2,3-dimethylbutyl]benzene
CID 83151864
1-(4-ethylphenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)amino]-3-methylbutan-1-ol
CID 82312760
2-(4-bromophenyl)-2-[(4-ethylphenyl)methyl]propane-1,3-diol
CID 79445511
1-(4-ethylphenyl)-3-methoxy-2-methylpropan-2-ol
CID 62535452
1-(3,3-dimethylbutan-2-yl)-4-ethylbenzene
CID 59048816

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethylphenyl)methyl]-2,3-dimethylbutan-1-ol?
The IUPAC name of 2-[(4-ethylphenyl)methyl]-2,3-dimethylbutan-1-ol (CID 83150614) is 2-[(4-ethylphenyl)methyl]-2,3-dimethylbutan-1-ol.
What is the SMILES notation for 2-[(4-ethylphenyl)methyl]-2,3-dimethylbutan-1-ol?
The canonical SMILES for 2-[(4-ethylphenyl)methyl]-2,3-dimethylbutan-1-ol is CCc1ccc(CC(C)(CO)C(C)C)cc1.
What is the InChIKey of 2-[(4-ethylphenyl)methyl]-2,3-dimethylbutan-1-ol?
The InChIKey is UZVBPTAFXDCKDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-5-13-6-8-14(9-7-13)10-15(4,11-16)12(2)3/h6-9,12,16H,5,10-11H2,1-4H3.
What are the key properties of 2-[(4-ethylphenyl)methyl]-2,3-dimethylbutan-1-ol?
2-[(4-ethylphenyl)methyl]-2,3-dimethylbutan-1-ol has a molecular weight of 220.36 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethylphenyl)methyl]-2,3-dimethylbutan-1-ol is sourced from PubChem (CID 83150614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).