2-amino-1-(2,6-dimethylmorpholin-4-yl)-4-methylpentan-1-one

C12H24N2O2 — CID 24690074

IUPAC2-amino-1-(2,6-dimethylmorpholin-4-yl)-4-methylpentan-1-one
SMILESCC(C)CC(N)C(=O)N1CC(C)OC(C)C1
InChIInChI=1S/C12H24N2O2/c1-8(2)5-11(13)12(15)14-6-9(3)16-10(4)7-14/h8-11H,5-7,13H2,1-4H3
InChIKeyFZALYKBJTVYQSS-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.00
Rot. Bonds3

About 2-amino-1-(2,6-dimethylmorpholin-4-yl)-4-methylpentan-1-one

2-amino-1-(2,6-dimethylmorpholin-4-yl)-4-methylpentan-1-one (PubChem CID 24690074) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-amino-1-(2,6-dimethylmorpholin-4-yl)-4-methylpentan-1-one.

Molecular Properties

Compound Name2-amino-1-(2,6-dimethylmorpholin-4-yl)-4-methylpentan-1-one
PubChem CID24690074
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-amino-1-(2,6-dimethylmorpholin-4-yl)-4-methylpentan-1-one
SMILESCC(C)CC(N)C(=O)N1CC(C)OC(C)C1
InChIInChI=1S/C12H24N2O2/c1-8(2)5-11(13)12(15)14-6-9(3)16-10(4)7-14/h8-11H,5-7,13H2,1-4H3
InChIKeyFZALYKBJTVYQSS-UHFFFAOYSA-N
XLogP1.00
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2,6-dimethylmorpholin-4-yl)-4-methylpentan-1-one?
The IUPAC name of 2-amino-1-(2,6-dimethylmorpholin-4-yl)-4-methylpentan-1-one (CID 24690074) is 2-amino-1-(2,6-dimethylmorpholin-4-yl)-4-methylpentan-1-one.
What is the SMILES notation for 2-amino-1-(2,6-dimethylmorpholin-4-yl)-4-methylpentan-1-one?
The canonical SMILES for 2-amino-1-(2,6-dimethylmorpholin-4-yl)-4-methylpentan-1-one is CC(C)CC(N)C(=O)N1CC(C)OC(C)C1.
What is the InChIKey of 2-amino-1-(2,6-dimethylmorpholin-4-yl)-4-methylpentan-1-one?
The InChIKey is FZALYKBJTVYQSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-8(2)5-11(13)12(15)14-6-9(3)16-10(4)7-14/h8-11H,5-7,13H2,1-4H3.
What are the key properties of 2-amino-1-(2,6-dimethylmorpholin-4-yl)-4-methylpentan-1-one?
2-amino-1-(2,6-dimethylmorpholin-4-yl)-4-methylpentan-1-one has a molecular weight of 228.34 g/mol, XLogP of 1.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2,6-dimethylmorpholin-4-yl)-4-methylpentan-1-one is sourced from PubChem (CID 24690074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).