methyl 2-methoxy-2-morpholin-4-ylacetate

C8H15NO4 — CID 12884742

IUPACmethyl 2-methoxy-2-morpholin-4-ylacetate
SMILESCOC(=O)C(OC)N1CCOCC1
InChIInChI=1S/C8H15NO4/c1-11-7(8(10)12-2)9-3-5-13-6-4-9/h7H,3-6H2,1-2H3
InChIKeyICMLGZWUGSCNBV-UHFFFAOYSA-N
MW189.21 g/mol
LogP-0.54
Rot. Bonds3

About methyl 2-methoxy-2-morpholin-4-ylacetate

methyl 2-methoxy-2-morpholin-4-ylacetate (PubChem CID 12884742) has the molecular formula C8H15NO4 and a molecular weight of 189.21 g/mol. Its IUPAC name is methyl 2-methoxy-2-morpholin-4-ylacetate.

Molecular Properties

Compound Namemethyl 2-methoxy-2-morpholin-4-ylacetate
PubChem CID12884742
Molecular FormulaC8H15NO4
Molecular Weight189.21 g/mol
Exact Mass189.10
IUPAC Namemethyl 2-methoxy-2-morpholin-4-ylacetate
SMILESCOC(=O)C(OC)N1CCOCC1
InChIInChI=1S/C8H15NO4/c1-11-7(8(10)12-2)9-3-5-13-6-4-9/h7H,3-6H2,1-2H3
InChIKeyICMLGZWUGSCNBV-UHFFFAOYSA-N
XLogP-0.54
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 5-0.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of methyl 2-methoxy-2-morpholin-4-ylacetate?
The IUPAC name of methyl 2-methoxy-2-morpholin-4-ylacetate (CID 12884742) is methyl 2-methoxy-2-morpholin-4-ylacetate.
What is the SMILES notation for methyl 2-methoxy-2-morpholin-4-ylacetate?
The canonical SMILES for methyl 2-methoxy-2-morpholin-4-ylacetate is COC(=O)C(OC)N1CCOCC1.
What is the InChIKey of methyl 2-methoxy-2-morpholin-4-ylacetate?
The InChIKey is ICMLGZWUGSCNBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO4/c1-11-7(8(10)12-2)9-3-5-13-6-4-9/h7H,3-6H2,1-2H3.
What are the key properties of methyl 2-methoxy-2-morpholin-4-ylacetate?
methyl 2-methoxy-2-morpholin-4-ylacetate has a molecular weight of 189.21 g/mol, XLogP of -0.54, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methoxy-2-morpholin-4-ylacetate is sourced from PubChem (CID 12884742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).