2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol

C14H22O3 — CID 117349589

IUPAC2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol
SMILESCCc1cc(OC)c(OC)c(C(C)(C)CO)c1
InChIInChI=1S/C14H22O3/c1-6-10-7-11(14(2,3)9-15)13(17-5)12(8-10)16-4/h7-8,15H,6,9H2,1-5H3
InChIKeyOTMOKPVTYXPBTM-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.54
Rot. Bonds5

About 2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol

2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol (PubChem CID 117349589) has the molecular formula C14H22O3 and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol
PubChem CID117349589
Molecular FormulaC14H22O3
Molecular Weight238.33 g/mol
Exact Mass238.16
IUPAC Name2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol
SMILESCCc1cc(OC)c(OC)c(C(C)(C)CO)c1
InChIInChI=1S/C14H22O3/c1-6-10-7-11(14(2,3)9-15)13(17-5)12(8-10)16-4/h7-8,15H,6,9H2,1-5H3
InChIKeyOTMOKPVTYXPBTM-UHFFFAOYSA-N
XLogP2.54
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(5-ethyl-2,3-dimethoxyphenyl)-3-methylbutanoic acid
CID 117419962
2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpropan-1-ol
CID 117349580
[3-(2-fluoropropan-2-yl)-4,5-dimethoxyphenyl]methanol
CID 84691885
1,3-ditert-butyl-5-ethyl-2-methoxybenzene;ethane
CID 143616670
2-[2,3-dimethoxy-5-(methoxymethyl)phenyl]propan-2-ol
CID 117353559
2-(3-bromo-2-fluoro-4,5-dimethoxyphenyl)-2-methylpropan-1-ol
CID 117492174
2,3-dimethyl-1,4-bis(3,4,5-trimethoxyphenyl)butane-2,3-diol
CID 10939314
2-(3-tert-butyl-2-methoxy-5-methylphenyl)-2-methylpropan-1-ol
CID 82297608
2-(3-ethyl-5-methoxyphenyl)-2-methylpropan-1-ol
CID 117297890
2-[3,4-dimethoxy-5-(trifluoromethyl)phenyl]ethanol
CID 117378332
2-methyl-2-(3,4,5-trimethoxy-N-methylanilino)propan-1-ol
CID 115133331
2-[4,5-dimethoxy-2-(trifluoromethyl)phenyl]-2-methylpropan-1-ol
CID 117445820

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol?
The IUPAC name of 2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol (CID 117349589) is 2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol.
What is the SMILES notation for 2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol?
The canonical SMILES for 2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol is CCc1cc(OC)c(OC)c(C(C)(C)CO)c1.
What is the InChIKey of 2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol?
The InChIKey is OTMOKPVTYXPBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O3/c1-6-10-7-11(14(2,3)9-15)13(17-5)12(8-10)16-4/h7-8,15H,6,9H2,1-5H3.
What are the key properties of 2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol?
2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol has a molecular weight of 238.33 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethyl-2,3-dimethoxyphenyl)-2-methylpropan-1-ol is sourced from PubChem (CID 117349589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).