4-amino-4-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-1-one

C14H28N2O2 — CID 102743762

IUPAC4-amino-4-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-1-one
SMILESCC(C)(N)CCC(=O)N1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C14H28N2O2/c1-12(2,15)8-7-11(17)16-9-13(3,4)18-14(5,6)10-16/h7-10,15H2,1-6H3
InChIKeyRUNUGFHMNPHWPA-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.92
Rot. Bonds3

About 4-amino-4-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-1-one

4-amino-4-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-1-one (PubChem CID 102743762) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 4-amino-4-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-1-one.

Molecular Properties

Compound Name4-amino-4-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-1-one
PubChem CID102743762
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name4-amino-4-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-1-one
SMILESCC(C)(N)CCC(=O)N1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C14H28N2O2/c1-12(2,15)8-7-11(17)16-9-13(3,4)18-14(5,6)10-16/h7-10,15H2,1-6H3
InChIKeyRUNUGFHMNPHWPA-UHFFFAOYSA-N
XLogP1.92
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(tert-butylamino)-1-(2,2,6,6-tetramethylmorpholin-4-yl)ethanone
CID 102737650
4-amino-1-(3-hydroxyazetidin-1-yl)-4-methylpentan-1-one
CID 107217564
4-(4-amino-4-methylpentanoyl)piperazine-2,6-dione
CID 66085002
4-amino-4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-1-one
CID 66370433
4-(2-aminoethyl)-5-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)hexan-1-one
CID 102743737
2-amino-3,3,3-trifluoro-2-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-one
CID 102743767
2-[2-oxo-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethyl]sulfanylacetic acid
CID 102743099
4-(propan-2-ylamino)-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-1-one
CID 102743692
2,2-dimethyl-1,5-bis(2,2,6-trimethylmorpholin-4-yl)pentane-1,5-dione
CID 136512690
4-amino-1-(1,3-dihydroisoindol-2-yl)-4-methylpentan-1-one
CID 23091988
2-hydroxy-2-methyl-3-[(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]propanoic acid
CID 102744953
3-amino-1-(3-hydroxy-3-methylazetidin-1-yl)-3-methylbutan-1-one
CID 107219358

Frequently Asked Questions

What is the IUPAC name of 4-amino-4-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-1-one?
The IUPAC name of 4-amino-4-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-1-one (CID 102743762) is 4-amino-4-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-1-one.
What is the SMILES notation for 4-amino-4-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-1-one?
The canonical SMILES for 4-amino-4-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-1-one is CC(C)(N)CCC(=O)N1CC(C)(C)OC(C)(C)C1.
What is the InChIKey of 4-amino-4-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-1-one?
The InChIKey is RUNUGFHMNPHWPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-12(2,15)8-7-11(17)16-9-13(3,4)18-14(5,6)10-16/h7-10,15H2,1-6H3.
What are the key properties of 4-amino-4-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-1-one?
4-amino-4-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-1-one has a molecular weight of 256.39 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-4-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-1-one is sourced from PubChem (CID 102743762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).