Methyl 4-[[2-(ethylamino)acetyl]amino]benzoate
Basic information
- CAS
100254-22-6- Standard SMILES
CCNCC(=O)Nc1ccc(C(=O)OC)cc1- InChIKey
VIRGYLGTPAHEMU-UHFFFAOYSA-N- Molecular formula
- C12H16N2O3
- Average molar mass
- 236.27 g/mol
- Monoisotopic mass
- 236.11609238
Names & identifiers
- Preferred name
- Methyl 4-[[2-(ethylamino)acetyl]amino]benzoate
- IUPAC
- methyl 4-[[2-(ethylamino)acetyl]amino]benzoate
Names & synonyms
methyl 4-[[2-(ethylamino)acetyl]amino]benzoateDTXSID201247994AKOS005323019Methyl 4-[(N-ethylglycyl)amino]benzoate100254-22-6
Database identifiers
- CAS
100254-22-6- PubChem CID
- 412416
- DTXSID
DTXSID201247994
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 260
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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