Ethyl (((1-adamantyl(ethyl)amino)carbonyl)amino)acetate
Basic information
- CAS
33205-91-3- Standard SMILES
CCOC(=O)CNC(=O)N(CC)C12CC3CC(CC(C3)C1)C2- InChIKey
PFWGQQSIJBNTDY-UHFFFAOYSA-N- Molecular formula
- C17H28N2O3
- Average molar mass
- 308.4 g/mol
- Monoisotopic mass
- 308.20999276
Names & identifiers
- Preferred name
- Ethyl (((1-adamantyl(ethyl)amino)carbonyl)amino)acetate
- IUPAC
- ethyl 2-[[1-adamantyl(ethyl)carbamoyl]amino]acetate
Names & synonyms
Ethyl (((1-adamantyl(ethyl)amino)carbonyl)amino)acetate33205-91-383YQW1DIC3UNII-83YQW1DIC3NSC 208912NSC-208912DTXSID60186854GLYCINE, N-(1-ADAMANTYLETHYLCARBAMOYL)-, ETHYL ESTERGLYCINE, N-((ETHYLTRICYCLO(3.3.1.13,7)DEC-1-YLAMINO)CARBONYL)-, ETHYL ESTERRefChem:138441DTXCID00109345CC 9093
Show more names
NSC208912ethyl 2-[[1-adamantyl(ethyl)carbamoyl]amino]acetateCHEMBL1966339NCI60_001751DS-010934Ethyl N-[(adamantan-1-yl)(ethyl)carbamoyl]glycinate
Database identifiers
- CAS
33205-91-3- PubChem CID
- 308221
- DTXSID
DTXSID60186854- ChEMBL
CHEMBL1966339- UNII
- 83YQW1DIC3
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 408
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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