methyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate

C10H17NO5 — CID 78927241

IUPACmethyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate
SMILESCCOC(=O)CN1CCOC(C(=O)OC)C1
InChIInChI=1S/C10H17NO5/c1-3-15-9(12)7-11-4-5-16-8(6-11)10(13)14-2/h8H,3-7H2,1-2H3
InChIKeyAWGKFIZZIAOQAX-UHFFFAOYSA-N
MW231.25 g/mol
LogP-0.58
Rot. Bonds4

About methyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate

methyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate (PubChem CID 78927241) has the molecular formula C10H17NO5 and a molecular weight of 231.25 g/mol. Its IUPAC name is methyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate.

Molecular Properties

Compound Namemethyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate
PubChem CID78927241
Molecular FormulaC10H17NO5
Molecular Weight231.25 g/mol
Exact Mass231.11
IUPAC Namemethyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate
SMILESCCOC(=O)CN1CCOC(C(=O)OC)C1
InChIInChI=1S/C10H17NO5/c1-3-15-9(12)7-11-4-5-16-8(6-11)10(13)14-2/h8H,3-7H2,1-2H3
InChIKeyAWGKFIZZIAOQAX-UHFFFAOYSA-N
XLogP-0.58
TPSA65.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 5-0.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

methyl 4-ethylmorpholine-2-carboxylate
CID 78926280
methyl 4-[2-oxo-2-(propylamino)ethyl]morpholine-2-carboxylate
CID 78926469
methyl 4-(2-ethoxyethyl)morpholine-2-carboxylate
CID 78927291
methyl 4-[2-(tert-butylamino)-2-oxoethyl]morpholine-2-carboxylate
CID 78926407
methyl 4-octylmorpholine-2-carboxylate
CID 79002818
methyl 4-[2-(cyclopentylamino)-2-oxoethyl]morpholine-2-carboxylate
CID 78926342
methyl 4-[(4-ethylmorpholin-2-yl)methyl]morpholine-2-carboxylate
CID 78946666
methyl 1-(2-ethoxy-2-oxoethyl)piperidine-3-carboxylate
CID 53421319
methyl 4-[(E)-but-2-enyl]morpholine-2-carboxylate
CID 78926479
ethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate
CID 129398069
ethyl 2-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]acetate
CID 102567699
methyl 4-[2-(benzylamino)-2-oxoethyl]morpholine-2-carboxylate
CID 78925882

Frequently Asked Questions

What is the IUPAC name of methyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate?
The IUPAC name of methyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate (CID 78927241) is methyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate.
What is the SMILES notation for methyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate?
The canonical SMILES for methyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate is CCOC(=O)CN1CCOC(C(=O)OC)C1.
What is the InChIKey of methyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate?
The InChIKey is AWGKFIZZIAOQAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO5/c1-3-15-9(12)7-11-4-5-16-8(6-11)10(13)14-2/h8H,3-7H2,1-2H3.
What are the key properties of methyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate?
methyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate has a molecular weight of 231.25 g/mol, XLogP of -0.58, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate is sourced from PubChem (CID 78927241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).