2-ethoxy-1-(2-methoxyphenyl)-N,3-dimethylbutan-1-amine

C15H25NO2 — CID 116721106

IUPAC2-ethoxy-1-(2-methoxyphenyl)-N,3-dimethylbutan-1-amine
SMILESCCOC(C(C)C)C(NC)c1ccccc1OC
InChIInChI=1S/C15H25NO2/c1-6-18-15(11(2)3)14(16-4)12-9-7-8-10-13(12)17-5/h7-11,14-16H,6H2,1-5H3
InChIKeyIWARORRQAFOJBZ-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.02
Rot. Bonds7

About 2-ethoxy-1-(2-methoxyphenyl)-N,3-dimethylbutan-1-amine

2-ethoxy-1-(2-methoxyphenyl)-N,3-dimethylbutan-1-amine (PubChem CID 116721106) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-ethoxy-1-(2-methoxyphenyl)-N,3-dimethylbutan-1-amine.

Molecular Properties

Compound Name2-ethoxy-1-(2-methoxyphenyl)-N,3-dimethylbutan-1-amine
PubChem CID116721106
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name2-ethoxy-1-(2-methoxyphenyl)-N,3-dimethylbutan-1-amine
SMILESCCOC(C(C)C)C(NC)c1ccccc1OC
InChIInChI=1S/C15H25NO2/c1-6-18-15(11(2)3)14(16-4)12-9-7-8-10-13(12)17-5/h7-11,14-16H,6H2,1-5H3
InChIKeyIWARORRQAFOJBZ-UHFFFAOYSA-N
XLogP3.02
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-1-(2-fluorophenyl)-N,3-dimethylbutan-1-amine
CID 116721271
2,2-diethoxy-1-(2-methoxyphenyl)-N-methylethanamine
CID 79496366
2-ethoxy-1-(2-methoxyphenyl)-N-methylpentan-1-amine
CID 116717712
[2-ethoxy-1-(2-fluoro-3-methoxyphenyl)-3-methylbutyl]hydrazine
CID 105272393
1-(2-methoxyphenyl)-N,2,3-trimethylbutan-1-amine
CID 115792789
2-ethoxy-1-isoquinolin-8-yl-N,3-dimethylbutan-1-amine
CID 103143806
1-(1-ethoxyethyl)-2-methoxybenzene
CID 141024824
1-(2,5-dimethylphenyl)-2-ethoxy-N,3-dimethylbutan-1-amine
CID 116721183
2-ethoxy-N,3-dimethyl-1-(4-propan-2-ylphenyl)butan-1-amine
CID 116721056
1-(2-methoxyphenyl)-N-methyl-2-propylpentan-1-amine
CID 115792570
1-(2-ethoxyphenyl)-N,2,3-trimethylbutan-1-amine
CID 115853624
1-(2-methoxyphenyl)-N,2-dimethylhexan-1-amine
CID 114246284

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-(2-methoxyphenyl)-N,3-dimethylbutan-1-amine?
The IUPAC name of 2-ethoxy-1-(2-methoxyphenyl)-N,3-dimethylbutan-1-amine (CID 116721106) is 2-ethoxy-1-(2-methoxyphenyl)-N,3-dimethylbutan-1-amine.
What is the SMILES notation for 2-ethoxy-1-(2-methoxyphenyl)-N,3-dimethylbutan-1-amine?
The canonical SMILES for 2-ethoxy-1-(2-methoxyphenyl)-N,3-dimethylbutan-1-amine is CCOC(C(C)C)C(NC)c1ccccc1OC.
What is the InChIKey of 2-ethoxy-1-(2-methoxyphenyl)-N,3-dimethylbutan-1-amine?
The InChIKey is IWARORRQAFOJBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-6-18-15(11(2)3)14(16-4)12-9-7-8-10-13(12)17-5/h7-11,14-16H,6H2,1-5H3.
What are the key properties of 2-ethoxy-1-(2-methoxyphenyl)-N,3-dimethylbutan-1-amine?
2-ethoxy-1-(2-methoxyphenyl)-N,3-dimethylbutan-1-amine has a molecular weight of 251.37 g/mol, XLogP of 3.02, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-(2-methoxyphenyl)-N,3-dimethylbutan-1-amine is sourced from PubChem (CID 116721106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).