2-(3-amino-2,6-dimethylphenoxy)ethanol

C10H15NO2 — CID 62018329

IUPAC2-(3-amino-2,6-dimethylphenoxy)ethanol
SMILESCc1ccc(N)c(C)c1OCCO
InChIInChI=1S/C10H15NO2/c1-7-3-4-9(11)8(2)10(7)13-6-5-12/h3-4,12H,5-6,11H2,1-2H3
InChIKeyUIEHSYOMGVGRKM-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.26
Rot. Bonds3

About 2-(3-amino-2,6-dimethylphenoxy)ethanol

2-(3-amino-2,6-dimethylphenoxy)ethanol (PubChem CID 62018329) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is 2-(3-amino-2,6-dimethylphenoxy)ethanol.

Molecular Properties

Compound Name2-(3-amino-2,6-dimethylphenoxy)ethanol
PubChem CID62018329
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name2-(3-amino-2,6-dimethylphenoxy)ethanol
SMILESCc1ccc(N)c(C)c1OCCO
InChIInChI=1S/C10H15NO2/c1-7-3-4-9(11)8(2)10(7)13-6-5-12/h3-4,12H,5-6,11H2,1-2H3
InChIKeyUIEHSYOMGVGRKM-UHFFFAOYSA-N
XLogP1.26
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[4-amino-2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol
CID 146405993
3-[3-(dimethylamino)propoxy]-2,4-dimethylaniline
CID 114524612
2,4-dimethyl-3-[2-(2-methylpropoxy)ethoxy]aniline
CID 106449319
2-(2-hydroxyethoxy)-3,6-dimethylphenol
CID 130131096
3-(2,2-difluoroethoxy)-2,4-dimethylaniline
CID 62018691
propan-2-yl 2-(3-amino-2,6-dimethylphenoxy)acetate
CID 62019077
2-(3-amino-2,6-dimethylphenoxy)-N-ethylacetamide
CID 62018130
2-[4-(2-hydroxyethoxy)-2,3-dimethylphenoxy]ethanol
CID 14025005
2-(3-amino-2,6-dimethylphenoxy)-N-tert-butylacetamide
CID 62018129
2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol
CID 139797700
2,4-dimethyl-3-[2-(1-methylpiperidin-2-yl)ethoxy]aniline
CID 107910970
2-(3-amino-2,6-dimethylphenoxy)-N-(1-methoxypropan-2-yl)acetamide
CID 62018700

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-2,6-dimethylphenoxy)ethanol?
The IUPAC name of 2-(3-amino-2,6-dimethylphenoxy)ethanol (CID 62018329) is 2-(3-amino-2,6-dimethylphenoxy)ethanol.
What is the SMILES notation for 2-(3-amino-2,6-dimethylphenoxy)ethanol?
The canonical SMILES for 2-(3-amino-2,6-dimethylphenoxy)ethanol is Cc1ccc(N)c(C)c1OCCO.
What is the InChIKey of 2-(3-amino-2,6-dimethylphenoxy)ethanol?
The InChIKey is UIEHSYOMGVGRKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-7-3-4-9(11)8(2)10(7)13-6-5-12/h3-4,12H,5-6,11H2,1-2H3.
What are the key properties of 2-(3-amino-2,6-dimethylphenoxy)ethanol?
2-(3-amino-2,6-dimethylphenoxy)ethanol has a molecular weight of 181.23 g/mol, XLogP of 1.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-2,6-dimethylphenoxy)ethanol is sourced from PubChem (CID 62018329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).