1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol

C19H32O2 — CID 103435642

IUPAC1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol
SMILESCCCCCCCCCC(O)c1ccc(C)c(C)c1OC
InChIInChI=1S/C19H32O2/c1-5-6-7-8-9-10-11-12-18(20)17-14-13-15(2)16(3)19(17)21-4/h13-14,18,20H,5-12H2,1-4H3
InChIKeyVBSXLZHMZXRQGC-UHFFFAOYSA-N
MW292.46 g/mol
LogP5.49
Rot. Bonds10

About 1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol

1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol (PubChem CID 103435642) has the molecular formula C19H32O2 and a molecular weight of 292.46 g/mol. Its IUPAC name is 1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol.

Molecular Properties

Compound Name1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol
PubChem CID103435642
Molecular FormulaC19H32O2
Molecular Weight292.46 g/mol
Exact Mass292.24
IUPAC Name1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol
SMILESCCCCCCCCCC(O)c1ccc(C)c(C)c1OC
InChIInChI=1S/C19H32O2/c1-5-6-7-8-9-10-11-12-18(20)17-14-13-15(2)16(3)19(17)21-4/h13-14,18,20H,5-12H2,1-4H3
InChIKeyVBSXLZHMZXRQGC-UHFFFAOYSA-N
XLogP5.49
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.46
LogP ≤ 55.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(2-methoxy-3,4-dimethylphenyl)decan-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

1-(2-methoxy-3,4-dimethylphenyl)-4-methylpentan-1-ol
CID 103433099
1-(4-methylnaphthalen-1-yl)heptan-1-ol
CID 114753428
1-(2-methoxy-3,4-dimethylphenyl)-2-methylsulfanylethanol
CID 103433114
1-(4-methoxy-2-methylphenyl)octan-1-ol
CID 61101302
(1R)-1-(2,3-dimethoxyphenyl)octan-1-ol
CID 124562849
2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol
CID 103434593
2-(2-methoxy-3,4-dimethylphenyl)hexanoic acid
CID 103434197
1-(4-methoxynaphthalen-1-yl)octan-1-ol
CID 63426458
1-(2,3-dimethylphenyl)octan-1-ol
CID 63900365
1-(2-methoxy-3,4-dimethylphenyl)-4-thiophen-2-ylbutan-1-ol
CID 103435667
1-(2-methoxy-3,4-dimethylphenyl)-2-(2-methoxyphenyl)ethanol
CID 103433092
1-(2-methoxy-3,4-dimethylphenyl)-N-methylbutan-1-amine
CID 103433382

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol?
The IUPAC name of 1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol (CID 103435642) is 1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol.
What is the SMILES notation for 1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol?
The canonical SMILES for 1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol is CCCCCCCCCC(O)c1ccc(C)c(C)c1OC.
What is the InChIKey of 1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol?
The InChIKey is VBSXLZHMZXRQGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32O2/c1-5-6-7-8-9-10-11-12-18(20)17-14-13-15(2)16(3)19(17)21-4/h13-14,18,20H,5-12H2,1-4H3.
What are the key properties of 1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol?
1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol has a molecular weight of 292.46 g/mol, XLogP of 5.49, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol is sourced from PubChem (CID 103435642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).