3-(3-ethylmorpholin-4-yl)-N,2,2-trimethylpropan-1-amine

C12H26N2O — CID 62257199

IUPAC3-(3-ethylmorpholin-4-yl)-N,2,2-trimethylpropan-1-amine
SMILESCCC1COCCN1CC(C)(C)CNC
InChIInChI=1S/C12H26N2O/c1-5-11-8-15-7-6-14(11)10-12(2,3)9-13-4/h11,13H,5-10H2,1-4H3
InChIKeyZOMOMUHETWSAMD-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.34
Rot. Bonds5

About 3-(3-ethylmorpholin-4-yl)-N,2,2-trimethylpropan-1-amine

3-(3-ethylmorpholin-4-yl)-N,2,2-trimethylpropan-1-amine (PubChem CID 62257199) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 3-(3-ethylmorpholin-4-yl)-N,2,2-trimethylpropan-1-amine.

Molecular Properties

Compound Name3-(3-ethylmorpholin-4-yl)-N,2,2-trimethylpropan-1-amine
PubChem CID62257199
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name3-(3-ethylmorpholin-4-yl)-N,2,2-trimethylpropan-1-amine
SMILESCCC1COCCN1CC(C)(C)CNC
InChIInChI=1S/C12H26N2O/c1-5-11-8-15-7-6-14(11)10-12(2,3)9-13-4/h11,13H,5-10H2,1-4H3
InChIKeyZOMOMUHETWSAMD-UHFFFAOYSA-N
XLogP1.34
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(3-ethylmorpholin-4-yl)-N,2,2-trimethylpropan-1-amine?
The IUPAC name of 3-(3-ethylmorpholin-4-yl)-N,2,2-trimethylpropan-1-amine (CID 62257199) is 3-(3-ethylmorpholin-4-yl)-N,2,2-trimethylpropan-1-amine.
What is the SMILES notation for 3-(3-ethylmorpholin-4-yl)-N,2,2-trimethylpropan-1-amine?
The canonical SMILES for 3-(3-ethylmorpholin-4-yl)-N,2,2-trimethylpropan-1-amine is CCC1COCCN1CC(C)(C)CNC.
What is the InChIKey of 3-(3-ethylmorpholin-4-yl)-N,2,2-trimethylpropan-1-amine?
The InChIKey is ZOMOMUHETWSAMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-5-11-8-15-7-6-14(11)10-12(2,3)9-13-4/h11,13H,5-10H2,1-4H3.
What are the key properties of 3-(3-ethylmorpholin-4-yl)-N,2,2-trimethylpropan-1-amine?
3-(3-ethylmorpholin-4-yl)-N,2,2-trimethylpropan-1-amine has a molecular weight of 214.35 g/mol, XLogP of 1.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethylmorpholin-4-yl)-N,2,2-trimethylpropan-1-amine is sourced from PubChem (CID 62257199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).