Benzoic acid, 4-(2-(diethylamino)acetamido)-3,5-dimethyl-, ethyl ester
Basic information
- CAS
3095-44-1- Standard SMILES
CCOC(=O)c1cc(C)c(NC(=O)CN(CC)CC)c(C)c1- InChIKey
HSKWGHBCIKPNJR-UHFFFAOYSA-N- Molecular formula
- C17H26N2O3
- Average molar mass
- 306.4 g/mol
- Monoisotopic mass
- 306.1943427
Names & identifiers
- Preferred name
- Benzoic acid, 4-(2-(diethylamino)acetamido)-3,5-dimethyl-, ethyl ester
- IUPAC
- ethyl 4-[[2-(diethylamino)acetyl]amino]-3,5-dimethylbenzoate
Names & synonyms
BRN 2391411BENZOIC ACID, 4-(2-(DIETHYLAMINO)ACETAMIDO)-3,5-DIMETHYL-, ETHYL ESTER3095-44-1DTXSID501849254-(2-(Diethylamino)acetamido)-3,5-dimethylbenzoic acid ethyl esterRefChem:327405DTXCID90107416Ethyl 4-[(N,N-diethylglycyl)amino]-3,5-dimethylbenzoate
Database identifiers
- CAS
3095-44-1- PubChem CID
- 18349
- DTXSID
DTXSID50184925
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 357
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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