4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic acid

C11H20N2O4 — CID 68715937

IUPAC4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic acid
SMILESCC1(C)CN(C(=O)C(C)(C)N)C(C(=O)O)CO1
InChIInChI=1S/C11H20N2O4/c1-10(2)6-13(9(16)11(3,4)12)7(5-17-10)8(14)15/h7H,5-6,12H2,1-4H3,(H,14,15)
InChIKeyYMSDORTUEMTYLW-UHFFFAOYSA-N
MW244.29 g/mol
LogP-0.19
Rot. Bonds2

About 4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic acid

4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic acid (PubChem CID 68715937) has the molecular formula C11H20N2O4 and a molecular weight of 244.29 g/mol. Its IUPAC name is 4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic acid.

Molecular Properties

Compound Name4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic acid
PubChem CID68715937
Molecular FormulaC11H20N2O4
Molecular Weight244.29 g/mol
Exact Mass244.14
IUPAC Name4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic acid
SMILESCC1(C)CN(C(=O)C(C)(C)N)C(C(=O)O)CO1
InChIInChI=1S/C11H20N2O4/c1-10(2)6-13(9(16)11(3,4)12)7(5-17-10)8(14)15/h7H,5-6,12H2,1-4H3,(H,14,15)
InChIKeyYMSDORTUEMTYLW-UHFFFAOYSA-N
XLogP-0.19
TPSA92.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic 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

4-(2-amino-3-methylbutyl)-6,6-dimethylmorpholine-3-carboxylic acid
CID 68523029
(3S)-6,6-dimethyl-4-(2-oxo-2-pyrrolidin-1-ylethyl)morpholine-3-carboxylic acid
CID 68523362
6,6-dimethyl-4-[2-[(2,2,2-trifluoroacetyl)amino]propyl]morpholine-3-carboxylic acid
CID 87484415
8-[(2-methylpropan-2-yl)oxycarbonyl]-5-oxa-8-azaspiro[3.5]nonane-7-carboxylic acid
CID 146155602
tert-butyl (5S)-5-(aminomethyl)-2,2-dimethylmorpholine-4-carboxylate
CID 155291086
4-[(2S)-2-(methanesulfonamido)propyl]-6,6-dimethylmorpholine-3-carboxylic acid
CID 68523816
6,6-dimethyl-4-[(2-methylpropan-2-yl)oxycarbonyl]-1,4-oxazepane-3-carboxylic acid
CID 155943304
2-(2-amino-2-methylpropanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
CID 61266832
tert-butyl 5-cyano-2,2-dimethylmorpholine-4-carboxylate
CID 155291753
1-(2-amino-2-methylpropanoyl)-4-methylpyrrolidine-3-carboxylic acid
CID 63720560
(5R)-4-tert-butyl-2,2,5-trimethylmorpholine
CID 168820806
(3S)-6,6-dimethyl-4-[2-oxo-2-(pyrimidin-4-ylmethylamino)ethyl]morpholine-3-carboxylic acid
CID 174514223

Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic acid?
The IUPAC name of 4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic acid (CID 68715937) is 4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic acid.
What is the SMILES notation for 4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic acid?
The canonical SMILES for 4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic acid is CC1(C)CN(C(=O)C(C)(C)N)C(C(=O)O)CO1.
What is the InChIKey of 4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic acid?
The InChIKey is YMSDORTUEMTYLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O4/c1-10(2)6-13(9(16)11(3,4)12)7(5-17-10)8(14)15/h7H,5-6,12H2,1-4H3,(H,14,15).
What are the key properties of 4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic acid?
4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic acid has a molecular weight of 244.29 g/mol, XLogP of -0.19, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-2-methylpropanoyl)-6,6-dimethylmorpholine-3-carboxylic acid is sourced from PubChem (CID 68715937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).