2-(2,6-dimethylmorpholin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-oxoacetamide

C12H22N2O4 — CID 108504128

IUPAC2-(2,6-dimethylmorpholin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-oxoacetamide
SMILESCC1CN(C(=O)C(=O)NC(C)(C)CO)CC(C)O1
InChIInChI=1S/C12H22N2O4/c1-8-5-14(6-9(2)18-8)11(17)10(16)13-12(3,4)7-15/h8-9,15H,5-7H2,1-4H3,(H,13,16)
InChIKeyXGILQJIIWCAMKU-UHFFFAOYSA-N
MW258.32 g/mol
LogP-0.49
Rot. Bonds2

About 2-(2,6-dimethylmorpholin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-oxoacetamide

2-(2,6-dimethylmorpholin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-oxoacetamide (PubChem CID 108504128) has the molecular formula C12H22N2O4 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-(2,6-dimethylmorpholin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-oxoacetamide.

Molecular Properties

Compound Name2-(2,6-dimethylmorpholin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-oxoacetamide
PubChem CID108504128
Molecular FormulaC12H22N2O4
Molecular Weight258.32 g/mol
Exact Mass258.16
IUPAC Name2-(2,6-dimethylmorpholin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-oxoacetamide
SMILESCC1CN(C(=O)C(=O)NC(C)(C)CO)CC(C)O1
InChIInChI=1S/C12H22N2O4/c1-8-5-14(6-9(2)18-8)11(17)10(16)13-12(3,4)7-15/h8-9,15H,5-7H2,1-4H3,(H,13,16)
InChIKeyXGILQJIIWCAMKU-UHFFFAOYSA-N
XLogP-0.49
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexyl-2-(2,6-dimethylmorpholin-4-yl)-2-oxoacetamide
CID 108503876
1-(2,6-dimethylmorpholin-4-yl)propane-1,2-dione
CID 131176238
1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methyl-2-(methylamino)propan-1-one
CID 94878561
2-(2,6-dimethylmorpholin-4-yl)-N,N-diethyl-2-oxoacetamide
CID 108504011
ethyl 2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoacetate
CID 7027814
3-amino-1-(2,6-dimethylmorpholin-4-yl)-3-methylbutan-1-one
CID 64684519
(2S,6S)-2,6-dimethylmorpholine-4-carboxylic acid
CID 137442866
1-(2,6-dimethylmorpholin-4-yl)ethanone
CID 3361054
2,6-dimethylmorpholine-4-carboxylic acid
CID 22047773
1-(2,6-dimethylmorpholin-4-yl)-2-(4-methylpiperazin-1-yl)ethane-1,2-dione
CID 108503946
1-(2,6-dimethylmorpholin-4-yl)-2-(4-ethylpiperazin-1-yl)ethane-1,2-dione
CID 108504048
2-(2,6-dimethylmorpholin-4-yl)-N-(furan-2-ylmethyl)-2-oxoacetamide
CID 108503950

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-oxoacetamide?
The IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-oxoacetamide (CID 108504128) is 2-(2,6-dimethylmorpholin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-oxoacetamide.
What is the SMILES notation for 2-(2,6-dimethylmorpholin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-oxoacetamide?
The canonical SMILES for 2-(2,6-dimethylmorpholin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-oxoacetamide is CC1CN(C(=O)C(=O)NC(C)(C)CO)CC(C)O1.
What is the InChIKey of 2-(2,6-dimethylmorpholin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-oxoacetamide?
The InChIKey is XGILQJIIWCAMKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O4/c1-8-5-14(6-9(2)18-8)11(17)10(16)13-12(3,4)7-15/h8-9,15H,5-7H2,1-4H3,(H,13,16).
What are the key properties of 2-(2,6-dimethylmorpholin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-oxoacetamide?
2-(2,6-dimethylmorpholin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-oxoacetamide has a molecular weight of 258.32 g/mol, XLogP of -0.49, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylmorpholin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-2-oxoacetamide is sourced from PubChem (CID 108504128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).