N-ethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine

C13H28N2O — CID 102743439

IUPACN-ethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine
SMILESCCNCCCN1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C13H28N2O/c1-6-14-8-7-9-15-10-12(2,3)16-13(4,5)11-15/h14H,6-11H2,1-5H3
InChIKeyJGEHKTOESZKXEX-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.88
Rot. Bonds5

About N-ethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine

N-ethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine (PubChem CID 102743439) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is N-ethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine
PubChem CID102743439
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC NameN-ethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine
SMILESCCNCCCN1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C13H28N2O/c1-6-14-8-7-9-15-10-12(2,3)16-13(4,5)11-15/h14H,6-11H2,1-5H3
InChIKeyJGEHKTOESZKXEX-UHFFFAOYSA-N
XLogP1.88
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.88
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

N-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine
CID 102743494
N-[2-(2,2,6,6-tetramethylmorpholin-4-yl)ethyl]ethanesulfonamide
CID 136534686
N-[3-(2,2,6,6-tetramethylmorpholin-4-yl)propyl]cyclopentanamine
CID 102746140
4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-1-ol
CID 102745117
N-ethyl-3-pyrrolidin-1-ylpropan-1-amine
CID 23440046
4-(5-bromopentyl)-2,2,6,6-tetramethylmorpholine
CID 102745281
4-(5-chloropentyl)-2,2,6,6-tetramethylmorpholine
CID 102745265
2-methyl-N-[2-(2,2,6,6-tetramethylmorpholin-4-yl)ethyl]propan-1-amine
CID 102745978
ethane;N-ethyl-3-morpholin-4-ylpropan-1-amine
CID 170595450
2-(ethylamino)-2-methyl-6-(2,2,6,6-tetramethylmorpholin-4-yl)hexanenitrile
CID 102745446
N-ethyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propan-1-amine
CID 66393443
N-ethyl-3-piperazin-1-ylpropan-1-amine
CID 89107698

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine?
The IUPAC name of N-ethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine (CID 102743439) is N-ethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine.
What is the SMILES notation for N-ethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine?
The canonical SMILES for N-ethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine is CCNCCCN1CC(C)(C)OC(C)(C)C1.
What is the InChIKey of N-ethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine?
The InChIKey is JGEHKTOESZKXEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-6-14-8-7-9-15-10-12(2,3)16-13(4,5)11-15/h14H,6-11H2,1-5H3.
What are the key properties of N-ethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine?
N-ethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine has a molecular weight of 228.38 g/mol, XLogP of 1.88, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine is sourced from PubChem (CID 102743439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).