2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)ethanol

C12H19NO2 — CID 116857211

IUPAC2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)ethanol
SMILESCOc1ccc(C(CO)N(C)C)cc1C
InChIInChI=1S/C12H19NO2/c1-9-7-10(5-6-12(9)15-4)11(8-14)13(2)3/h5-7,11,14H,8H2,1-4H3
InChIKeyXOKMIJRHMWMCFB-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.60
Rot. Bonds4

About 2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)ethanol

2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)ethanol (PubChem CID 116857211) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)ethanol
PubChem CID116857211
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)ethanol
SMILESCOc1ccc(C(CO)N(C)C)cc1C
InChIInChI=1S/C12H19NO2/c1-9-7-10(5-6-12(9)15-4)11(8-14)13(2)3/h5-7,11,14H,8H2,1-4H3
InChIKeyXOKMIJRHMWMCFB-UHFFFAOYSA-N
XLogP1.60
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxy-3-methylphenyl)-2-(methylamino)ethanol
CID 62132456
1-(4-methoxy-3-methylphenyl)-N,N,3,3-tetramethylbutane-1,4-diamine
CID 116905729
2-[2-(dimethylamino)ethylamino]-2-(4-methoxy-3-methylphenyl)ethanol
CID 62132457
(1S)-1-(4-methoxy-3-methylphenyl)ethanol
CID 39236071
3-amino-1-(dimethylamino)-1-(4-methoxy-3-methylphenyl)propan-2-ol
CID 116911674
ethyl 2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)acetate
CID 116914223
1-(4-methoxy-3-methylphenyl)-N,N-dimethyl-2-pyrrolidin-3-ylethanamine
CID 116906723
methyl 3-(4-methoxy-3-methylphenyl)-4-methylpentanoate
CID 112508803
(3R)-3-amino-3-(4-methoxy-3-methylphenyl)propan-1-ol
CID 55265729
3-(3-chloro-4-methoxyphenyl)-3-(dimethylamino)propan-1-ol
CID 83928505
3-(3-bromo-4-methoxyphenyl)-3-(dimethylamino)propan-1-ol
CID 83926098
methyl 3-amino-3-(4-methoxy-3-methylphenyl)propanoate
CID 62132611

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)ethanol?
The IUPAC name of 2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)ethanol (CID 116857211) is 2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)ethanol.
What is the SMILES notation for 2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)ethanol?
The canonical SMILES for 2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)ethanol is COc1ccc(C(CO)N(C)C)cc1C.
What is the InChIKey of 2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)ethanol?
The InChIKey is XOKMIJRHMWMCFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-9-7-10(5-6-12(9)15-4)11(8-14)13(2)3/h5-7,11,14H,8H2,1-4H3.
What are the key properties of 2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)ethanol?
2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)ethanol has a molecular weight of 209.29 g/mol, XLogP of 1.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-2-(4-methoxy-3-methylphenyl)ethanol is sourced from PubChem (CID 116857211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).