1,2-dimethoxyethane;methyl 2-(methylamino)acetate

C8H19NO4 — CID 161160255

IUPAC1,2-dimethoxyethane;methyl 2-(methylamino)acetate
SMILESCNCC(=O)OC.COCCOC
InChIInChI=1S/C4H9NO2.C4H10O2/c1-5-3-4(6)7-2;1-5-3-4-6-2/h5H,3H2,1-2H3;3-4H2,1-2H3
InChIKeyUPVDNUSCBXXRDP-UHFFFAOYSA-N
MW193.24 g/mol
LogP-0.34
Rot. Bonds5

About 1,2-dimethoxyethane;methyl 2-(methylamino)acetate

1,2-dimethoxyethane;methyl 2-(methylamino)acetate (PubChem CID 161160255) has the molecular formula C8H19NO4 and a molecular weight of 193.24 g/mol. Its IUPAC name is 1,2-dimethoxyethane;methyl 2-(methylamino)acetate.

Molecular Properties

Compound Name1,2-dimethoxyethane;methyl 2-(methylamino)acetate
PubChem CID161160255
Molecular FormulaC8H19NO4
Molecular Weight193.24 g/mol
Exact Mass193.13
IUPAC Name1,2-dimethoxyethane;methyl 2-(methylamino)acetate
SMILESCNCC(=O)OC.COCCOC
InChIInChI=1S/C4H9NO2.C4H10O2/c1-5-3-4(6)7-2;1-5-3-4-6-2/h5H,3H2,1-2H3;3-4H2,1-2H3
InChIKeyUPVDNUSCBXXRDP-UHFFFAOYSA-N
XLogP-0.34
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.24
LogP ≤ 5-0.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

azane;methyl 2-(methylamino)acetate
CID 87200278
2-(2-methoxyethoxy)ethyl 2-(methylamino)acetate
CID 104563542
1,2-dimethoxyethane;methyl 2-methoxyacetate
CID 159708370
sulfanyl 2-(methylamino)acetate
CID 150047574
2-aminoethyl 2-(methylamino)acetate
CID 174621897
phosphono 2-(methylamino)acetate
CID 54056266
1,2-dimethoxyethane;N-methylmethanamine
CID 175177446
methyl 2-(4-methoxybutanoylamino)acetate
CID 112729446
methyl 2-[[2-(2-methoxyethoxy)acetyl]amino]acetate
CID 43431221
methyl 4-methoxybutanoate
CID 542317
methyl 2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetate
CID 91694163
butyl 2-(methylamino)acetate;methane
CID 157477406

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethoxyethane;methyl 2-(methylamino)acetate?
The IUPAC name of 1,2-dimethoxyethane;methyl 2-(methylamino)acetate (CID 161160255) is 1,2-dimethoxyethane;methyl 2-(methylamino)acetate.
What is the SMILES notation for 1,2-dimethoxyethane;methyl 2-(methylamino)acetate?
The canonical SMILES for 1,2-dimethoxyethane;methyl 2-(methylamino)acetate is CNCC(=O)OC.COCCOC.
What is the InChIKey of 1,2-dimethoxyethane;methyl 2-(methylamino)acetate?
The InChIKey is UPVDNUSCBXXRDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO2.C4H10O2/c1-5-3-4(6)7-2;1-5-3-4-6-2/h5H,3H2,1-2H3;3-4H2,1-2H3.
What are the key properties of 1,2-dimethoxyethane;methyl 2-(methylamino)acetate?
1,2-dimethoxyethane;methyl 2-(methylamino)acetate has a molecular weight of 193.24 g/mol, XLogP of -0.34, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethoxyethane;methyl 2-(methylamino)acetate is sourced from PubChem (CID 161160255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).