2-(3,4-diethylphenyl)-2-methylpropan-1-ol

C14H22O — CID 117295283

IUPAC2-(3,4-diethylphenyl)-2-methylpropan-1-ol
SMILESCCc1ccc(C(C)(C)CO)cc1CC
InChIInChI=1S/C14H22O/c1-5-11-7-8-13(9-12(11)6-2)14(3,4)10-15/h7-9,15H,5-6,10H2,1-4H3
InChIKeyWRAPWKZPDAXHJW-UHFFFAOYSA-N
MW206.33 g/mol
LogP3.08
Rot. Bonds4

About 2-(3,4-diethylphenyl)-2-methylpropan-1-ol

2-(3,4-diethylphenyl)-2-methylpropan-1-ol (PubChem CID 117295283) has the molecular formula C14H22O and a molecular weight of 206.33 g/mol. Its IUPAC name is 2-(3,4-diethylphenyl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-(3,4-diethylphenyl)-2-methylpropan-1-ol
PubChem CID117295283
Molecular FormulaC14H22O
Molecular Weight206.33 g/mol
Exact Mass206.17
IUPAC Name2-(3,4-diethylphenyl)-2-methylpropan-1-ol
SMILESCCc1ccc(C(C)(C)CO)cc1CC
InChIInChI=1S/C14H22O/c1-5-11-7-8-13(9-12(11)6-2)14(3,4)10-15/h7-9,15H,5-6,10H2,1-4H3
InChIKeyWRAPWKZPDAXHJW-UHFFFAOYSA-N
XLogP3.08
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(3,4-diethylphenyl)-N,3-dimethylbutan-1-amine
CID 113319299
3-[4-(1-hydroxy-2-methylpropan-2-yl)-2-methylphenyl]propanal
CID 139329715
2-ethyl-4-(2-methylbutan-2-yl)phenol
CID 13132257
2-(3,4-diaminophenyl)-2-methylpropan-1-ol
CID 144721361
2-[4-[2-[4-(1-hydroxy-2-methylpropan-2-yl)phenyl]propan-2-yl]phenyl]-2-methylpropan-1-ol
CID 14440449
2-[4-fluoro-3-(methoxymethyl)phenyl]-2-methylpropan-1-ol
CID 117303145
2-(4-bromo-3-methylphenyl)-2-methylpropan-1-ol
CID 117359057
1-ethyl-2-fluoro-4-(2-methylbutan-2-yl)benzene
CID 170009086
1-[4-(1-hydroxy-2-methylpropan-2-yl)phenyl]propan-2-one
CID 117114960
2-(4-methoxy-3-methylphenyl)-2-methylpropan-1-ol
CID 82125771
5-(5-tert-butyl-2-ethylphenyl)-4-methylpentan-2-one
CID 83927567
2-(3-chloro-4-methylsulfonylphenyl)-2-methylpropan-1-ol
CID 105425091

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-diethylphenyl)-2-methylpropan-1-ol?
The IUPAC name of 2-(3,4-diethylphenyl)-2-methylpropan-1-ol (CID 117295283) is 2-(3,4-diethylphenyl)-2-methylpropan-1-ol.
What is the SMILES notation for 2-(3,4-diethylphenyl)-2-methylpropan-1-ol?
The canonical SMILES for 2-(3,4-diethylphenyl)-2-methylpropan-1-ol is CCc1ccc(C(C)(C)CO)cc1CC.
What is the InChIKey of 2-(3,4-diethylphenyl)-2-methylpropan-1-ol?
The InChIKey is WRAPWKZPDAXHJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O/c1-5-11-7-8-13(9-12(11)6-2)14(3,4)10-15/h7-9,15H,5-6,10H2,1-4H3.
What are the key properties of 2-(3,4-diethylphenyl)-2-methylpropan-1-ol?
2-(3,4-diethylphenyl)-2-methylpropan-1-ol has a molecular weight of 206.33 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-diethylphenyl)-2-methylpropan-1-ol is sourced from PubChem (CID 117295283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).