3,3-diethyl-5,5-dimethyl-4-(methylamino)morpholin-2-one

C11H22N2O2 — CID 142036948

IUPAC3,3-diethyl-5,5-dimethyl-4-(methylamino)morpholin-2-one
SMILESCCC1(CC)C(=O)OCC(C)(C)N1NC
InChIInChI=1S/C11H22N2O2/c1-6-11(7-2)9(14)15-8-10(3,4)13(11)12-5/h12H,6-8H2,1-5H3
InChIKeyKMACTRQANZDZIZ-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.32
Rot. Bonds3

About 3,3-diethyl-5,5-dimethyl-4-(methylamino)morpholin-2-one

3,3-diethyl-5,5-dimethyl-4-(methylamino)morpholin-2-one (PubChem CID 142036948) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 3,3-diethyl-5,5-dimethyl-4-(methylamino)morpholin-2-one.

Molecular Properties

Compound Name3,3-diethyl-5,5-dimethyl-4-(methylamino)morpholin-2-one
PubChem CID142036948
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name3,3-diethyl-5,5-dimethyl-4-(methylamino)morpholin-2-one
SMILESCCC1(CC)C(=O)OCC(C)(C)N1NC
InChIInChI=1S/C11H22N2O2/c1-6-11(7-2)9(14)15-8-10(3,4)13(11)12-5/h12H,6-8H2,1-5H3
InChIKeyKMACTRQANZDZIZ-UHFFFAOYSA-N
XLogP1.32
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,3-diethyl-5,5-dimethyl-4-(methylamino)morpholin-2-one?
The IUPAC name of 3,3-diethyl-5,5-dimethyl-4-(methylamino)morpholin-2-one (CID 142036948) is 3,3-diethyl-5,5-dimethyl-4-(methylamino)morpholin-2-one.
What is the SMILES notation for 3,3-diethyl-5,5-dimethyl-4-(methylamino)morpholin-2-one?
The canonical SMILES for 3,3-diethyl-5,5-dimethyl-4-(methylamino)morpholin-2-one is CCC1(CC)C(=O)OCC(C)(C)N1NC.
What is the InChIKey of 3,3-diethyl-5,5-dimethyl-4-(methylamino)morpholin-2-one?
The InChIKey is KMACTRQANZDZIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-6-11(7-2)9(14)15-8-10(3,4)13(11)12-5/h12H,6-8H2,1-5H3.
What are the key properties of 3,3-diethyl-5,5-dimethyl-4-(methylamino)morpholin-2-one?
3,3-diethyl-5,5-dimethyl-4-(methylamino)morpholin-2-one has a molecular weight of 214.31 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diethyl-5,5-dimethyl-4-(methylamino)morpholin-2-one is sourced from PubChem (CID 142036948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).