2-(5-ethyl-2-methylmorpholin-4-yl)-2-methyloctan-1-amine

C16H34N2O — CID 61424178

IUPAC2-(5-ethyl-2-methylmorpholin-4-yl)-2-methyloctan-1-amine
SMILESCCCCCCC(C)(CN)N1CC(C)OCC1CC
InChIInChI=1S/C16H34N2O/c1-5-7-8-9-10-16(4,13-17)18-11-14(3)19-12-15(18)6-2/h14-15H,5-13,17H2,1-4H3
InChIKeyXQNRKRBAUIYJQH-UHFFFAOYSA-N
MW270.46 g/mol
LogP3.17
Rot. Bonds8

About 2-(5-ethyl-2-methylmorpholin-4-yl)-2-methyloctan-1-amine

2-(5-ethyl-2-methylmorpholin-4-yl)-2-methyloctan-1-amine (PubChem CID 61424178) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is 2-(5-ethyl-2-methylmorpholin-4-yl)-2-methyloctan-1-amine.

Molecular Properties

Compound Name2-(5-ethyl-2-methylmorpholin-4-yl)-2-methyloctan-1-amine
PubChem CID61424178
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Name2-(5-ethyl-2-methylmorpholin-4-yl)-2-methyloctan-1-amine
SMILESCCCCCCC(C)(CN)N1CC(C)OCC1CC
InChIInChI=1S/C16H34N2O/c1-5-7-8-9-10-16(4,13-17)18-11-14(3)19-12-15(18)6-2/h14-15H,5-13,17H2,1-4H3
InChIKeyXQNRKRBAUIYJQH-UHFFFAOYSA-N
XLogP3.17
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(5-ethyl-2-methylmorpholin-4-yl)-2-propylpentan-1-amine
CID 61423784
2-methyl-2-(2-methylmorpholin-4-yl)nonan-1-amine
CID 43130140
2-(5-ethyl-2-methylmorpholin-4-yl)-2,3-dimethylbutan-1-amine
CID 61424280
2-(2,6-dimethylmorpholin-4-yl)-2-methyloctan-1-amine
CID 43089493
2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine
CID 43266378
2-(5-ethyl-2-methylmorpholin-4-yl)-3,3-dimethoxy-2-methylpropan-1-amine
CID 66180240
2-(3,4-dimethylpyrrolidin-1-yl)-2-methylheptan-1-amine
CID 80557534
2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylnonan-1-amine
CID 62885069
2-methyl-2-(2-propan-2-ylpyrrolidin-1-yl)heptan-1-amine
CID 80557427
2-(3-methoxypyrrolidin-1-yl)-2-methylheptan-1-amine
CID 103531540
1-(6-methyldodecan-6-yl)azetidin-3-amine
CID 130337700
2-(4-tert-butylpiperidin-1-yl)-2-methylnonan-1-amine
CID 63465793

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethyl-2-methylmorpholin-4-yl)-2-methyloctan-1-amine?
The IUPAC name of 2-(5-ethyl-2-methylmorpholin-4-yl)-2-methyloctan-1-amine (CID 61424178) is 2-(5-ethyl-2-methylmorpholin-4-yl)-2-methyloctan-1-amine.
What is the SMILES notation for 2-(5-ethyl-2-methylmorpholin-4-yl)-2-methyloctan-1-amine?
The canonical SMILES for 2-(5-ethyl-2-methylmorpholin-4-yl)-2-methyloctan-1-amine is CCCCCCC(C)(CN)N1CC(C)OCC1CC.
What is the InChIKey of 2-(5-ethyl-2-methylmorpholin-4-yl)-2-methyloctan-1-amine?
The InChIKey is XQNRKRBAUIYJQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-5-7-8-9-10-16(4,13-17)18-11-14(3)19-12-15(18)6-2/h14-15H,5-13,17H2,1-4H3.
What are the key properties of 2-(5-ethyl-2-methylmorpholin-4-yl)-2-methyloctan-1-amine?
2-(5-ethyl-2-methylmorpholin-4-yl)-2-methyloctan-1-amine has a molecular weight of 270.46 g/mol, XLogP of 3.17, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethyl-2-methylmorpholin-4-yl)-2-methyloctan-1-amine is sourced from PubChem (CID 61424178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).