ethyl 2-methyl-2-morpholin-4-ylpropanoate

C10H19NO3 — CID 13022015

IUPACethyl 2-methyl-2-morpholin-4-ylpropanoate
SMILESCCOC(=O)C(C)(C)N1CCOCC1
InChIInChI=1S/C10H19NO3/c1-4-14-9(12)10(2,3)11-5-7-13-8-6-11/h4-8H2,1-3H3
InChIKeyYBAUKWDRWDHULW-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.66
Rot. Bonds3

About ethyl 2-methyl-2-morpholin-4-ylpropanoate

ethyl 2-methyl-2-morpholin-4-ylpropanoate (PubChem CID 13022015) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is ethyl 2-methyl-2-morpholin-4-ylpropanoate.

Molecular Properties

Compound Nameethyl 2-methyl-2-morpholin-4-ylpropanoate
PubChem CID13022015
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Nameethyl 2-methyl-2-morpholin-4-ylpropanoate
SMILESCCOC(=O)C(C)(C)N1CCOCC1
InChIInChI=1S/C10H19NO3/c1-4-14-9(12)10(2,3)11-5-7-13-8-6-11/h4-8H2,1-3H3
InChIKeyYBAUKWDRWDHULW-UHFFFAOYSA-N
XLogP0.66
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
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

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Related Compounds

ethyl 3-methyl-3-morpholin-4-ylpentanoate
CID 64528777
ethyl 2-amino-4-methyl-4-morpholin-4-ylpentanoate
CID 170885030
ethyl 5-methoxy-3,5-dimethyl-3-morpholin-4-ylhexanoate
CID 64528974
ethyl 2-amino-2-methyl-4-(1,4-oxazepan-4-yl)butanoate
CID 62974765
2-methyl-2-morpholin-4-ylpropanoyl iodide
CID 155067930
2-methyl-2-morpholin-4-ylpropanoate
CID 25219445
ethyl 2-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propanoate
CID 58135874
3-methyl-3-morpholin-4-ylpentanoic acid
CID 64527149
[2-[(4S)-2,4-dimethyloctan-2-yl]oxy-2-oxoethyl] 2-methyl-2-morpholin-4-ylpropanoate
CID 170223279
2-methyl-2-morpholin-4-ylbutanoic acid
CID 43803225
diethyl 2-(morpholin-4-ylmethyl)-2-prop-2-enylpropanedioate
CID 21204648
ethyl 2-methyl-2-(4-morpholin-4-ylphenyl)pentanoate
CID 142202810

Frequently Asked Questions

What is the IUPAC name of ethyl 2-methyl-2-morpholin-4-ylpropanoate?
The IUPAC name of ethyl 2-methyl-2-morpholin-4-ylpropanoate (CID 13022015) is ethyl 2-methyl-2-morpholin-4-ylpropanoate.
What is the SMILES notation for ethyl 2-methyl-2-morpholin-4-ylpropanoate?
The canonical SMILES for ethyl 2-methyl-2-morpholin-4-ylpropanoate is CCOC(=O)C(C)(C)N1CCOCC1.
What is the InChIKey of ethyl 2-methyl-2-morpholin-4-ylpropanoate?
The InChIKey is YBAUKWDRWDHULW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-4-14-9(12)10(2,3)11-5-7-13-8-6-11/h4-8H2,1-3H3.
What are the key properties of ethyl 2-methyl-2-morpholin-4-ylpropanoate?
ethyl 2-methyl-2-morpholin-4-ylpropanoate has a molecular weight of 201.27 g/mol, XLogP of 0.66, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-methyl-2-morpholin-4-ylpropanoate is sourced from PubChem (CID 13022015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).