methyl 2-[methoxycarbonyl(methyl)amino]acetate

C6H11NO4 — CID 43409148

IUPACmethyl 2-[methoxycarbonyl(methyl)amino]acetate
SMILESCOC(=O)CN(C)C(=O)OC
InChIInChI=1S/C6H11NO4/c1-7(6(9)11-3)4-5(8)10-2/h4H2,1-3H3
InChIKeyKMDMMEWZKMIKRK-UHFFFAOYSA-N
MW161.16 g/mol
LogP-0.14
Rot. Bonds2

About methyl 2-[methoxycarbonyl(methyl)amino]acetate

methyl 2-[methoxycarbonyl(methyl)amino]acetate (PubChem CID 43409148) has the molecular formula C6H11NO4 and a molecular weight of 161.16 g/mol. Its IUPAC name is methyl 2-[methoxycarbonyl(methyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[methoxycarbonyl(methyl)amino]acetate
PubChem CID43409148
Molecular FormulaC6H11NO4
Molecular Weight161.16 g/mol
Exact Mass161.07
IUPAC Namemethyl 2-[methoxycarbonyl(methyl)amino]acetate
SMILESCOC(=O)CN(C)C(=O)OC
InChIInChI=1S/C6H11NO4/c1-7(6(9)11-3)4-5(8)10-2/h4H2,1-3H3
InChIKeyKMDMMEWZKMIKRK-UHFFFAOYSA-N
XLogP-0.14
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.16
LogP ≤ 5-0.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of methyl 2-[methoxycarbonyl(methyl)amino]acetate?
The IUPAC name of methyl 2-[methoxycarbonyl(methyl)amino]acetate (CID 43409148) is methyl 2-[methoxycarbonyl(methyl)amino]acetate.
What is the SMILES notation for methyl 2-[methoxycarbonyl(methyl)amino]acetate?
The canonical SMILES for methyl 2-[methoxycarbonyl(methyl)amino]acetate is COC(=O)CN(C)C(=O)OC.
What is the InChIKey of methyl 2-[methoxycarbonyl(methyl)amino]acetate?
The InChIKey is KMDMMEWZKMIKRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO4/c1-7(6(9)11-3)4-5(8)10-2/h4H2,1-3H3.
What are the key properties of methyl 2-[methoxycarbonyl(methyl)amino]acetate?
methyl 2-[methoxycarbonyl(methyl)amino]acetate has a molecular weight of 161.16 g/mol, XLogP of -0.14, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[methoxycarbonyl(methyl)amino]acetate is sourced from PubChem (CID 43409148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).