2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid

C13H24N2O4 — CID 43631730

IUPAC2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid
SMILESCCCC(NCC(=O)N1CC(C)OC(C)C1)C(=O)O
InChIInChI=1S/C13H24N2O4/c1-4-5-11(13(17)18)14-6-12(16)15-7-9(2)19-10(3)8-15/h9-11,14H,4-8H2,1-3H3,(H,17,18)
InChIKeyDUISVLDVEQMUAS-UHFFFAOYSA-N
MW272.35 g/mol
LogP0.47
Rot. Bonds6

About 2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid

2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid (PubChem CID 43631730) has the molecular formula C13H24N2O4 and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid.

Molecular Properties

Compound Name2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid
PubChem CID43631730
Molecular FormulaC13H24N2O4
Molecular Weight272.35 g/mol
Exact Mass272.17
IUPAC Name2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid
SMILESCCCC(NCC(=O)N1CC(C)OC(C)C1)C(=O)O
InChIInChI=1S/C13H24N2O4/c1-4-5-11(13(17)18)14-6-12(16)15-7-9(2)19-10(3)8-15/h9-11,14H,4-8H2,1-3H3,(H,17,18)
InChIKeyDUISVLDVEQMUAS-UHFFFAOYSA-N
XLogP0.47
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-2-[[2-[(3S,5R)-3,5-dimethylpiperidin-1-yl]-2-oxoethyl]amino]pentanoic acid
CID 93252644
1-(2,6-dimethylmorpholin-4-yl)-2-(propylamino)ethanone
CID 60687539
(2S)-2-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]-3-hydroxypropanoic acid
CID 104959540
3-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]propanoic acid
CID 43466609
1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-2-(propan-2-ylamino)ethanone
CID 102932666
1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-ethoxyethanone
CID 2163030
2-amino-1-(2,6-dimethylmorpholin-4-yl)pentan-1-one
CID 43649994
[1-(2,6-dimethylmorpholin-4-yl)-1-oxobutan-2-yl]carbamic acid
CID 134519440
3-[[(2S,6R)-2,6-dimethylmorpholine-4-carbonyl]amino]-2-methylpropanoic acid
CID 104959652
(2S)-5-amino-2-[[(2S,6R)-2,6-dimethylmorpholine-4-carbonyl]amino]-5-oxopentanoic acid
CID 104959619
2-bromo-1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethanone
CID 53216148
[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]sulfanium
CID 153278899

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid?
The IUPAC name of 2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid (CID 43631730) is 2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid.
What is the SMILES notation for 2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid?
The canonical SMILES for 2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid is CCCC(NCC(=O)N1CC(C)OC(C)C1)C(=O)O.
What is the InChIKey of 2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid?
The InChIKey is DUISVLDVEQMUAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O4/c1-4-5-11(13(17)18)14-6-12(16)15-7-9(2)19-10(3)8-15/h9-11,14H,4-8H2,1-3H3,(H,17,18).
What are the key properties of 2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid?
2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid has a molecular weight of 272.35 g/mol, XLogP of 0.47, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]amino]pentanoic acid is sourced from PubChem (CID 43631730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).