2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine

C17H28N2O — CID 43562607

IUPAC2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine
SMILESCCC1CN(CC(N)c2c(C)cc(C)cc2C)CCO1
InChIInChI=1S/C17H28N2O/c1-5-15-10-19(6-7-20-15)11-16(18)17-13(3)8-12(2)9-14(17)4/h8-9,15-16H,5-7,10-11,18H2,1-4H3
InChIKeyNQXSCMJYYGOIQD-UHFFFAOYSA-N
MW276.42 g/mol
LogP2.72
Rot. Bonds4

About 2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine

2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine (PubChem CID 43562607) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is 2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine.

Molecular Properties

Compound Name2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine
PubChem CID43562607
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine
SMILESCCC1CN(CC(N)c2c(C)cc(C)cc2C)CCO1
InChIInChI=1S/C17H28N2O/c1-5-15-10-19(6-7-20-15)11-16(18)17-13(3)8-12(2)9-14(17)4/h8-9,15-16H,5-7,10-11,18H2,1-4H3
InChIKeyNQXSCMJYYGOIQD-UHFFFAOYSA-N
XLogP2.72
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,4-dimethylphenyl)-2-(2-ethylmorpholin-4-yl)ethanamine
CID 43562608
1-(3,4-dimethylphenyl)-2-(2-ethylmorpholin-4-yl)ethanamine
CID 43562594
(2S)-1-(2-ethylmorpholin-4-yl)propan-2-amine
CID 103934483
2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine
CID 115291142
2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-(2,4,6-trimethylphenyl)ethanamine
CID 64569538
2,4-diethylmorpholine
CID 58988021
2-(3,4-dimethoxypyrrolidin-1-yl)-1-(2,4,6-trimethylphenyl)ethanamine
CID 103532480
4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine
CID 80544103
3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine
CID 43562330
2-(2-ethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanamine
CID 104744806
2-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)ethanamine
CID 65154946
2-amino-4-(2-ethylmorpholin-4-yl)butanoic acid
CID 63028647

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine?
The IUPAC name of 2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine (CID 43562607) is 2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine.
What is the SMILES notation for 2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine?
The canonical SMILES for 2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine is CCC1CN(CC(N)c2c(C)cc(C)cc2C)CCO1.
What is the InChIKey of 2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine?
The InChIKey is NQXSCMJYYGOIQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-5-15-10-19(6-7-20-15)11-16(18)17-13(3)8-12(2)9-14(17)4/h8-9,15-16H,5-7,10-11,18H2,1-4H3.
What are the key properties of 2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine?
2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine has a molecular weight of 276.42 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine is sourced from PubChem (CID 43562607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).