2-(4-ethyl-2-methoxyphenoxy)-N,2-dimethylpropan-1-amine

C14H23NO2 — CID 107668292

IUPAC2-(4-ethyl-2-methoxyphenoxy)-N,2-dimethylpropan-1-amine
SMILESCCc1ccc(OC(C)(C)CNC)c(OC)c1
InChIInChI=1S/C14H23NO2/c1-6-11-7-8-12(13(9-11)16-5)17-14(2,3)10-15-4/h7-9,15H,6,10H2,1-5H3
InChIKeyZPKMEPZALSUPIY-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.63
Rot. Bonds6

About 2-(4-ethyl-2-methoxyphenoxy)-N,2-dimethylpropan-1-amine

2-(4-ethyl-2-methoxyphenoxy)-N,2-dimethylpropan-1-amine (PubChem CID 107668292) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 2-(4-ethyl-2-methoxyphenoxy)-N,2-dimethylpropan-1-amine.

Molecular Properties

Compound Name2-(4-ethyl-2-methoxyphenoxy)-N,2-dimethylpropan-1-amine
PubChem CID107668292
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name2-(4-ethyl-2-methoxyphenoxy)-N,2-dimethylpropan-1-amine
SMILESCCc1ccc(OC(C)(C)CNC)c(OC)c1
InChIInChI=1S/C14H23NO2/c1-6-11-7-8-12(13(9-11)16-5)17-14(2,3)10-15-4/h7-9,15H,6,10H2,1-5H3
InChIKeyZPKMEPZALSUPIY-UHFFFAOYSA-N
XLogP2.63
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(5-ethyl-2-methoxyphenyl)-N-methylmethanediamine
CID 115226519
2-N-[(3,4-dimethoxyphenyl)methyl]-1-N,2-dimethylpropane-1,2-diamine
CID 115132665
N-(bromomethyl)-5-ethyl-2-methoxyaniline
CID 115261556
3,3-dimethylbutan-1-ol;ethane;4-ethyl-1,2-dimethoxybenzene
CID 143005011
N-ethyl-2-(5-ethyl-2-methoxyphenyl)-2-methylpropan-1-amine
CID 112518134
N'-[(5-ethyl-2-methoxyphenyl)methyl]-N,N'-dimethylmethanediamine
CID 115227004
[3-methoxy-4-[(2-methylpropan-2-yl)oxy]phenyl]methanol
CID 139947952
3-(4-ethyl-2-methoxyphenoxy)-N-methylcyclobutan-1-amine
CID 107669459
3-(5-ethyl-2-methoxyanilino)-2,2-dimethylpropan-1-ol
CID 115135120
1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine
CID 107666919
3,5-dichloro-6-(4-ethyl-2-methoxyphenoxy)-N-methylpyridin-2-amine
CID 107669668
2-(4-ethyl-2-methoxyphenoxy)ethanol
CID 67567470

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethyl-2-methoxyphenoxy)-N,2-dimethylpropan-1-amine?
The IUPAC name of 2-(4-ethyl-2-methoxyphenoxy)-N,2-dimethylpropan-1-amine (CID 107668292) is 2-(4-ethyl-2-methoxyphenoxy)-N,2-dimethylpropan-1-amine.
What is the SMILES notation for 2-(4-ethyl-2-methoxyphenoxy)-N,2-dimethylpropan-1-amine?
The canonical SMILES for 2-(4-ethyl-2-methoxyphenoxy)-N,2-dimethylpropan-1-amine is CCc1ccc(OC(C)(C)CNC)c(OC)c1.
What is the InChIKey of 2-(4-ethyl-2-methoxyphenoxy)-N,2-dimethylpropan-1-amine?
The InChIKey is ZPKMEPZALSUPIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-6-11-7-8-12(13(9-11)16-5)17-14(2,3)10-15-4/h7-9,15H,6,10H2,1-5H3.
What are the key properties of 2-(4-ethyl-2-methoxyphenoxy)-N,2-dimethylpropan-1-amine?
2-(4-ethyl-2-methoxyphenoxy)-N,2-dimethylpropan-1-amine has a molecular weight of 237.34 g/mol, XLogP of 2.63, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethyl-2-methoxyphenoxy)-N,2-dimethylpropan-1-amine is sourced from PubChem (CID 107668292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).