1-(2-Cyanoethyl)-1-cyclohexyl-3-phenylurea
Basic information
- CAS
6640-06-8- Standard SMILES
N#CCCN(C(=O)Nc1ccccc1)C1CCCCC1- InChIKey
RDJSRFGHUDSEHG-UHFFFAOYSA-N- Molecular formula
- C16H21N3O
- Average molar mass
- 271.36 g/mol
- Monoisotopic mass
- 271.1684623
Names & identifiers
- Preferred name
- 1-(2-Cyanoethyl)-1-cyclohexyl-3-phenylurea
- IUPAC
- 1-(2-cyanoethyl)-1-cyclohexyl-3-phenylurea
Names & synonyms
MLS0026672386640-06-81-(2-cyanoethyl)-1-cyclohexyl-3-phenylureaNSC49071CHEMBL1866551DTXSID30287125HMS3079G08NSC-49071AKOS024384745SMR001557007ST51035245N-(2-Cyanoethyl)-N-cyclohexyl-N'-phenylurea
Show more names
N-(2-cyanoethyl)-N-cyclohexyl(phenylamino)carboxamide
Database identifiers
- CAS
6640-06-8- PubChem CID
- 241564
- DTXSID
DTXSID30287125- ChEMBL
CHEMBL1866551
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 56.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 348
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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