1-[4-[2-(ethylamino)ethyl]morpholin-2-yl]-2-methylpropan-2-amine

C12H27N3O — CID 90732568

IUPAC1-[4-[2-(ethylamino)ethyl]morpholin-2-yl]-2-methylpropan-2-amine
SMILESCCNCCN1CCOC(CC(C)(C)N)C1
InChIInChI=1S/C12H27N3O/c1-4-14-5-6-15-7-8-16-11(10-15)9-12(2,3)13/h11,14H,4-10,13H2,1-3H3
InChIKeyDAEZDQPOIWNETH-UHFFFAOYSA-N
MW229.37 g/mol
LogP0.42
Rot. Bonds6

About 1-[4-[2-(ethylamino)ethyl]morpholin-2-yl]-2-methylpropan-2-amine

1-[4-[2-(ethylamino)ethyl]morpholin-2-yl]-2-methylpropan-2-amine (PubChem CID 90732568) has the molecular formula C12H27N3O and a molecular weight of 229.37 g/mol. Its IUPAC name is 1-[4-[2-(ethylamino)ethyl]morpholin-2-yl]-2-methylpropan-2-amine.

Molecular Properties

Compound Name1-[4-[2-(ethylamino)ethyl]morpholin-2-yl]-2-methylpropan-2-amine
PubChem CID90732568
Molecular FormulaC12H27N3O
Molecular Weight229.37 g/mol
Exact Mass229.22
IUPAC Name1-[4-[2-(ethylamino)ethyl]morpholin-2-yl]-2-methylpropan-2-amine
SMILESCCNCCN1CCOC(CC(C)(C)N)C1
InChIInChI=1S/C12H27N3O/c1-4-14-5-6-15-7-8-16-11(10-15)9-12(2,3)13/h11,14H,4-10,13H2,1-3H3
InChIKeyDAEZDQPOIWNETH-UHFFFAOYSA-N
XLogP0.42
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.37
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

Dimethyl(2-(piperidin-4-yloxy)ethyl)amine
CID 43167826
Diethyl[2-(piperidin-4-yloxy)ethyl]amine
CID 43346288
9-Methyl-2-oxa-6,9-diazaspiro(4.5)decane
CID 121207667
6-Methyl-2-oxa-6,9-diazaspiro[4.5]decane
CID 84021039
[3-Ethoxy-1-(morpholin-4-yl)cyclobutyl]methanamine
CID 86775697
(S)-2-Isobutylmorpholine
CID 28064247
N-[3-[(2R)-4-(2-fluoroethyl)morpholin-2-yl]propyl]-2-methylpropan-2-amine
CID 166926466
2-(1-tert-butyl-3-fluoropiperidin-4-yl)oxy-N-methylethanamine
CID 172148718
2-(5-Ethyl-2-methylmorpholin-4-yl)-6,6,6-trifluoro-2-methylhexan-1-amine
CID 116535193
6,6,6-Trifluoro-2-methyl-2-(3-propoxypiperidin-1-yl)hexan-1-amine
CID 116535226
2-(3-Ethoxypiperidin-1-yl)-6,6,6-trifluoro-2-methylhexan-1-amine
CID 116535227
(2S)-4-methyl-1-morpholin-4-ylpentan-2-amine
CID 18649577

Frequently Asked Questions

What is the IUPAC name of 1-[4-[2-(ethylamino)ethyl]morpholin-2-yl]-2-methylpropan-2-amine?
The IUPAC name of 1-[4-[2-(ethylamino)ethyl]morpholin-2-yl]-2-methylpropan-2-amine (CID 90732568) is 1-[4-[2-(ethylamino)ethyl]morpholin-2-yl]-2-methylpropan-2-amine.
What is the SMILES notation for 1-[4-[2-(ethylamino)ethyl]morpholin-2-yl]-2-methylpropan-2-amine?
The canonical SMILES for 1-[4-[2-(ethylamino)ethyl]morpholin-2-yl]-2-methylpropan-2-amine is CCNCCN1CCOC(CC(C)(C)N)C1.
What is the InChIKey of 1-[4-[2-(ethylamino)ethyl]morpholin-2-yl]-2-methylpropan-2-amine?
The InChIKey is DAEZDQPOIWNETH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3O/c1-4-14-5-6-15-7-8-16-11(10-15)9-12(2,3)13/h11,14H,4-10,13H2,1-3H3.
What are the key properties of 1-[4-[2-(ethylamino)ethyl]morpholin-2-yl]-2-methylpropan-2-amine?
1-[4-[2-(ethylamino)ethyl]morpholin-2-yl]-2-methylpropan-2-amine has a molecular weight of 229.37 g/mol, XLogP of 0.42, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[2-(ethylamino)ethyl]morpholin-2-yl]-2-methylpropan-2-amine is sourced from PubChem (CID 90732568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).