2-ethyl-N-(2-methoxyphenyl)-N,N',2-trimethylpropane-1,3-diamine

C15H26N2O — CID 62260433

IUPAC2-ethyl-N-(2-methoxyphenyl)-N,N',2-trimethylpropane-1,3-diamine
SMILESCCC(C)(CNC)CN(C)c1ccccc1OC
InChIInChI=1S/C15H26N2O/c1-6-15(2,11-16-3)12-17(4)13-9-7-8-10-14(13)18-5/h7-10,16H,6,11-12H2,1-5H3
InChIKeyBWUYMEIXHJMZHW-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.77
Rot. Bonds7

About 2-ethyl-N-(2-methoxyphenyl)-N,N',2-trimethylpropane-1,3-diamine

2-ethyl-N-(2-methoxyphenyl)-N,N',2-trimethylpropane-1,3-diamine (PubChem CID 62260433) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 2-ethyl-N-(2-methoxyphenyl)-N,N',2-trimethylpropane-1,3-diamine.

Molecular Properties

Compound Name2-ethyl-N-(2-methoxyphenyl)-N,N',2-trimethylpropane-1,3-diamine
PubChem CID62260433
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name2-ethyl-N-(2-methoxyphenyl)-N,N',2-trimethylpropane-1,3-diamine
SMILESCCC(C)(CNC)CN(C)c1ccccc1OC
InChIInChI=1S/C15H26N2O/c1-6-15(2,11-16-3)12-17(4)13-9-7-8-10-14(13)18-5/h7-10,16H,6,11-12H2,1-5H3
InChIKeyBWUYMEIXHJMZHW-UHFFFAOYSA-N
XLogP2.77
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-2-ethyl-N'-(2-methoxyphenyl)-N',2-dimethylpropane-1,3-diamine
CID 62260778
N-cyclopropyl-2-ethyl-N'-(2-methoxyphenyl)-N',2-dimethylpropane-1,3-diamine
CID 62260608
N-(2-methoxyphenyl)-N,2,2-trimethyl-N'-propan-2-ylpropane-1,3-diamine
CID 62259584
N-cyclopropyl-2,2-diethyl-N'-(2-methoxyphenyl)-N'-methylpropane-1,3-diamine
CID 62259922
2-methoxy-N-methyl-N-propylaniline
CID 23198488
N-(hydrazinylmethyl)-2-methoxy-N-methylaniline
CID 115260697
2-cyclopropyl-2-(ethylamino)-3-(2-methoxy-N-methylanilino)propan-1-ol
CID 64791730
2-(ethylamino)-4-(2-methoxy-N-methylanilino)-2-methylbutan-1-ol
CID 64791522
2-cyclopropyl-3-(2-methoxy-N-methylanilino)-2-(propylamino)propanenitrile
CID 63914238
2-(ethylamino)-6-(2-methoxy-N-methylanilino)-2-methylhexan-1-ol
CID 64790716
3-(2-methoxy-N-methylanilino)-2-(methylamino)propan-1-ol
CID 64791521
1-N-tert-butyl-2-N-(2-methoxyphenyl)-2-N-methylpropane-1,2-diamine
CID 55074176

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(2-methoxyphenyl)-N,N',2-trimethylpropane-1,3-diamine?
The IUPAC name of 2-ethyl-N-(2-methoxyphenyl)-N,N',2-trimethylpropane-1,3-diamine (CID 62260433) is 2-ethyl-N-(2-methoxyphenyl)-N,N',2-trimethylpropane-1,3-diamine.
What is the SMILES notation for 2-ethyl-N-(2-methoxyphenyl)-N,N',2-trimethylpropane-1,3-diamine?
The canonical SMILES for 2-ethyl-N-(2-methoxyphenyl)-N,N',2-trimethylpropane-1,3-diamine is CCC(C)(CNC)CN(C)c1ccccc1OC.
What is the InChIKey of 2-ethyl-N-(2-methoxyphenyl)-N,N',2-trimethylpropane-1,3-diamine?
The InChIKey is BWUYMEIXHJMZHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-6-15(2,11-16-3)12-17(4)13-9-7-8-10-14(13)18-5/h7-10,16H,6,11-12H2,1-5H3.
What are the key properties of 2-ethyl-N-(2-methoxyphenyl)-N,N',2-trimethylpropane-1,3-diamine?
2-ethyl-N-(2-methoxyphenyl)-N,N',2-trimethylpropane-1,3-diamine has a molecular weight of 250.39 g/mol, XLogP of 2.77, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(2-methoxyphenyl)-N,N',2-trimethylpropane-1,3-diamine is sourced from PubChem (CID 62260433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).