azane;methyl 2-(methylamino)acetate

C4H12N2O2 — CID 87200278

IUPACazane;methyl 2-(methylamino)acetate
SMILESCNCC(=O)OC.N
InChIInChI=1S/C4H9NO2.H3N/c1-5-3-4(6)7-2;/h5H,3H2,1-2H3;1H3
InChIKeySHMFMOLKWQPTSX-UHFFFAOYSA-N
MW120.15 g/mol
LogP-0.46
Rot. Bonds2

About azane;methyl 2-(methylamino)acetate

azane;methyl 2-(methylamino)acetate (PubChem CID 87200278) has the molecular formula C4H12N2O2 and a molecular weight of 120.15 g/mol. Its IUPAC name is azane;methyl 2-(methylamino)acetate.

Molecular Properties

Compound Nameazane;methyl 2-(methylamino)acetate
PubChem CID87200278
Molecular FormulaC4H12N2O2
Molecular Weight120.15 g/mol
Exact Mass120.09
IUPAC Nameazane;methyl 2-(methylamino)acetate
SMILESCNCC(=O)OC.N
InChIInChI=1S/C4H9NO2.H3N/c1-5-3-4(6)7-2;/h5H,3H2,1-2H3;1H3
InChIKeySHMFMOLKWQPTSX-UHFFFAOYSA-N
XLogP-0.46
TPSA73.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.15
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of azane;methyl 2-(methylamino)acetate?
The IUPAC name of azane;methyl 2-(methylamino)acetate (CID 87200278) is azane;methyl 2-(methylamino)acetate.
What is the SMILES notation for azane;methyl 2-(methylamino)acetate?
The canonical SMILES for azane;methyl 2-(methylamino)acetate is CNCC(=O)OC.N.
What is the InChIKey of azane;methyl 2-(methylamino)acetate?
The InChIKey is SHMFMOLKWQPTSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO2.H3N/c1-5-3-4(6)7-2;/h5H,3H2,1-2H3;1H3.
What are the key properties of azane;methyl 2-(methylamino)acetate?
azane;methyl 2-(methylamino)acetate has a molecular weight of 120.15 g/mol, XLogP of -0.46, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azane;methyl 2-(methylamino)acetate is sourced from PubChem (CID 87200278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).