2-[(2,2-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid

C12H22N2O5 — CID 79270357

IUPAC2-[(2,2-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid
SMILESCOCCN(CC(=O)O)C(=O)N1CCOC(C)(C)C1
InChIInChI=1S/C12H22N2O5/c1-12(2)9-14(5-7-19-12)11(17)13(4-6-18-3)8-10(15)16/h4-9H2,1-3H3,(H,15,16)
InChIKeyHEVUVFISHKEVBX-UHFFFAOYSA-N
MW274.32 g/mol
LogP0.25
Rot. Bonds5

About 2-[(2,2-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid

2-[(2,2-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid (PubChem CID 79270357) has the molecular formula C12H22N2O5 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-[(2,2-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid.

Molecular Properties

Compound Name2-[(2,2-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid
PubChem CID79270357
Molecular FormulaC12H22N2O5
Molecular Weight274.32 g/mol
Exact Mass274.15
IUPAC Name2-[(2,2-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid
SMILESCOCCN(CC(=O)O)C(=O)N1CCOC(C)(C)C1
InChIInChI=1S/C12H22N2O5/c1-12(2)9-14(5-7-19-12)11(17)13(4-6-18-3)8-10(15)16/h4-9H2,1-3H3,(H,15,16)
InChIKeyHEVUVFISHKEVBX-UHFFFAOYSA-N
XLogP0.25
TPSA79.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3,3-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid
CID 79271152
N-(2-hydroxyethyl)-N-(2-methoxyethyl)morpholine-4-carboxamide
CID 115608967
1-[2-methoxyethyl(3-methoxypropyl)carbamoyl]-3-methylpyrrolidine-3-carboxylic acid
CID 63147332
1-(2,2-dimethylmorpholin-4-yl)-2-(2-methoxyethylamino)ethanone
CID 79282191
2-[2-methoxyethyl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridine-1-carbonyl]amino]acetic acid
CID 114490470
2-[2-methoxyethyl-(3-methylmorpholine-4-carbonyl)amino]acetic acid
CID 79271907
N,N-bis(2-methoxyethyl)piperidine-1-carboxamide
CID 115578688
2-[2-methoxyethyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetic acid
CID 54969051
2-[(3-methoxycarbonylpiperidine-1-carbonyl)-(2-methoxyethyl)amino]acetic acid
CID 115535207
2-[2-methoxyethyl-[3-(trifluoromethyl)piperidine-1-carbonyl]amino]acetic acid
CID 79272734
5-(2,2-dimethylmorpholin-4-yl)-3-methyl-5-oxopentanoic acid
CID 62964019
N-(2-cyanoethyl)-N-(2-methoxyethyl)morpholine-4-carboxamide
CID 79156132

Frequently Asked Questions

What is the IUPAC name of 2-[(2,2-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid?
The IUPAC name of 2-[(2,2-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid (CID 79270357) is 2-[(2,2-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid.
What is the SMILES notation for 2-[(2,2-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid?
The canonical SMILES for 2-[(2,2-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid is COCCN(CC(=O)O)C(=O)N1CCOC(C)(C)C1.
What is the InChIKey of 2-[(2,2-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid?
The InChIKey is HEVUVFISHKEVBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O5/c1-12(2)9-14(5-7-19-12)11(17)13(4-6-18-3)8-10(15)16/h4-9H2,1-3H3,(H,15,16).
What are the key properties of 2-[(2,2-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid?
2-[(2,2-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid has a molecular weight of 274.32 g/mol, XLogP of 0.25, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,2-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid is sourced from PubChem (CID 79270357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).