2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine

C14H23NO2 — CID 62108025

IUPAC2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine
SMILESCNCC(OC(C)(C)C)c1ccc(OC)cc1
InChIInChI=1S/C14H23NO2/c1-14(2,3)17-13(10-15-4)11-6-8-12(16-5)9-7-11/h6-9,13,15H,10H2,1-5H3
InChIKeyNEKBRIFAAGNEAB-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.77
Rot. Bonds5

About 2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine

2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine (PubChem CID 62108025) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine
PubChem CID62108025
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine
SMILESCNCC(OC(C)(C)C)c1ccc(OC)cc1
InChIInChI=1S/C14H23NO2/c1-14(2,3)17-13(10-15-4)11-6-8-12(16-5)9-7-11/h6-9,13,15H,10H2,1-5H3
InChIKeyNEKBRIFAAGNEAB-UHFFFAOYSA-N
XLogP2.77
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyphenyl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine
CID 62109907
2-(4-methoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine
CID 53276269
2-(4-methoxyphenyl)-N-methyl-2-pentoxyethanamine
CID 62110727
1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene
CID 102295760
(2S)-2-methoxy-N-methyl-2-[4-(trifluoromethyl)phenyl]ethanamine
CID 92974659
2-(4-methoxyphenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine
CID 62107386
3-(4-methoxyphenyl)-N,2-dimethylbutan-1-amine
CID 81016213
2-(1-ethoxypropan-2-yloxy)-2-(4-methoxyphenyl)-N-methylethanamine
CID 103490183
(2R)-N-[2-(2-chloro-3,4-dimethoxyphenyl)ethyl]-2-(4-methoxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanamine
CID 92950933
2-(4-methoxyphenyl)-N-methyl-2-octan-2-yloxyethanamine
CID 62108868
1-(6-methoxynaphthalen-2-yl)-3-(methylamino)propane-1,2-diol
CID 171858748
3-(6-methoxynaphthalen-2-yl)-N-methyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine
CID 159228228

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine?
The IUPAC name of 2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine (CID 62108025) is 2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine?
The canonical SMILES for 2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine is CNCC(OC(C)(C)C)c1ccc(OC)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine?
The InChIKey is NEKBRIFAAGNEAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-14(2,3)17-13(10-15-4)11-6-8-12(16-5)9-7-11/h6-9,13,15H,10H2,1-5H3.
What are the key properties of 2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine?
2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine has a molecular weight of 237.34 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine is sourced from PubChem (CID 62108025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).