Ethyl 2-(cyanoimino)-1-pyrrolidineacetate
Basic information
- CAS
150012-85-4- Standard SMILES
CCOC(=O)CN1CCCC1=NC#N- InChIKey
HPYCSSKGXITAHU-UHFFFAOYSA-N- Molecular formula
- C9H13N3O2
- Average molar mass
- 195.22 g/mol
- Monoisotopic mass
- 195.10077667
Names & identifiers
- Preferred name
- Ethyl 2-(cyanoimino)-1-pyrrolidineacetate
- IUPAC
- ethyl 2-(2-cyanoiminopyrrolidin-1-yl)acetate
Names & synonyms
Ethyl 2-(cyanoimino)-1-pyrrolidineacetate1-Ethoxycarbonyl-2-cyanopyrrolidine1-Pyrrolidineacetic acid, 2-(cyanoimino)-, ethyl ester150012-85-4SCHEMBL31714994AKOS024341373ETHYL (2-(CYANOIMINO)-1-PYRROLIDINYL)ACETATE
Database identifiers
- CAS
150012-85-4- PubChem CID
- 3073573
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 65.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 290
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Compound notes
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