methyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate

C10H19NO3 — CID 103936716

IUPACmethyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate
SMILESCOC(=O)C(C)N1C[C@@H](C)O[C@@H](C)C1
InChIInChI=1S/C10H19NO3/c1-7-5-11(6-8(2)14-7)9(3)10(12)13-4/h7-9H,5-6H2,1-4H3/t7-,8+,9?
InChIKeyZKCRIKYQFUMXLX-JVHMLUBASA-N
MW201.27 g/mol
LogP0.66
Rot. Bonds2

About methyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate

methyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate (PubChem CID 103936716) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is methyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate.

Molecular Properties

Compound Namemethyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate
PubChem CID103936716
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Namemethyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate
SMILESCOC(=O)C(C)N1C[C@@H](C)O[C@@H](C)C1
InChIInChI=1S/C10H19NO3/c1-7-5-11(6-8(2)14-7)9(3)10(12)13-4/h7-9H,5-6H2,1-4H3/t7-,8+,9?
InChIKeyZKCRIKYQFUMXLX-JVHMLUBASA-N
XLogP0.66
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze methyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate 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

2-(2,6-dimethylmorpholin-4-yl)propanamide
CID 60644884
1,2-bis(2,6-dimethylmorpholin-4-yl)propan-1-one
CID 78786496
methyl 2-(2-methyl-1,4-oxazepan-4-yl)propanoate
CID 62972695
methyl 3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]butanoate
CID 104959277
methyl 2-(2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl)propanoate
CID 60915542
4-[(2S)-1-methoxy-1-oxopropan-2-yl]-2,6-dimethylpiperazine-1-carboxylic acid
CID 154945106
methyl (2S)-2-[[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]amino]propanoate
CID 941681
methyl 2-(3-azabicyclo[3.3.1]nonan-3-yl)propanoate
CID 130479743
1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methoxypropan-1-one
CID 103932975
1-(4-aminophenyl)-2-(2,6-dimethylmorpholin-4-yl)propan-1-one
CID 82256494
methyl (2R)-2-morpholin-4-ylpropanoate
CID 30030777
methyl 2-(3-hydroxypyrrolidin-1-yl)propanoate
CID 62918498

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate?
The IUPAC name of methyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate (CID 103936716) is methyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate.
What is the SMILES notation for methyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate?
The canonical SMILES for methyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate is COC(=O)C(C)N1C[C@@H](C)O[C@@H](C)C1.
What is the InChIKey of methyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate?
The InChIKey is ZKCRIKYQFUMXLX-JVHMLUBASA-N. The full InChI is InChI=1S/C10H19NO3/c1-7-5-11(6-8(2)14-7)9(3)10(12)13-4/h7-9H,5-6H2,1-4H3/t7-,8+,9?.
What are the key properties of methyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate?
methyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate has a molecular weight of 201.27 g/mol, XLogP of 0.66, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate is sourced from PubChem (CID 103936716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).