2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol

C13H21NO2 — CID 103434593

IUPAC2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol
SMILESCCNCC(O)c1ccc(C)c(C)c1OC
InChIInChI=1S/C13H21NO2/c1-5-14-8-12(15)11-7-6-9(2)10(3)13(11)16-4/h6-7,12,14-15H,5,8H2,1-4H3
InChIKeyOGRQVZVTZNYMQF-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.95
Rot. Bonds5

About 2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol

2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol (PubChem CID 103434593) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol.

Molecular Properties

Compound Name2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol
PubChem CID103434593
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Name2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol
SMILESCCNCC(O)c1ccc(C)c(C)c1OC
InChIInChI=1S/C13H21NO2/c1-5-14-8-12(15)11-7-6-9(2)10(3)13(11)16-4/h6-7,12,14-15H,5,8H2,1-4H3
InChIKeyOGRQVZVTZNYMQF-UHFFFAOYSA-N
XLogP1.95
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxy-3,4-dimethylphenyl)-2-methylsulfanylethanol
CID 103433114
1-(2-methoxy-3,4-dimethylphenyl)decan-1-ol
CID 103435642
1-(2-methoxy-3,4-dimethylphenyl)-4-methylpentan-1-ol
CID 103433099
methyl 2-(2-methoxy-3,4-dimethylphenyl)butanoate
CID 103434208
1-(2-methoxy-3,4-dimethylphenyl)-2-methylbutane-1,2-diol
CID 103448788
1-(2-methoxy-3,4-dimethylphenyl)-2-(2-methoxyphenyl)ethanol
CID 103433092
1-(2-methoxy-3,4-dimethylphenyl)-2,2-dimethylpropan-1-ol
CID 103432558
1-(2-methoxy-3,4-dimethylphenyl)-N-methylbutan-1-amine
CID 103433382
1-(3-bromo-2,4-dimethoxyphenyl)-2-(propylamino)ethanol
CID 103524083
2-(4-fluorophenyl)sulfanyl-1-(2-methoxy-3,4-dimethylphenyl)ethanol
CID 103433160
2-(dimethylamino)-2-ethyl-1-(2-methoxy-3,4-dimethylphenyl)butan-1-ol
CID 103433176
1-(2,4-dimethoxy-3-methylphenyl)-N'-ethyl-N-methylethane-1,2-diamine
CID 116950345

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol?
The IUPAC name of 2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol (CID 103434593) is 2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol.
What is the SMILES notation for 2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol?
The canonical SMILES for 2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol is CCNCC(O)c1ccc(C)c(C)c1OC.
What is the InChIKey of 2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol?
The InChIKey is OGRQVZVTZNYMQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-5-14-8-12(15)11-7-6-9(2)10(3)13(11)16-4/h6-7,12,14-15H,5,8H2,1-4H3.
What are the key properties of 2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol?
2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol has a molecular weight of 223.32 g/mol, XLogP of 1.95, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol is sourced from PubChem (CID 103434593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).