N-[3-[Bis(2-cyanoethyl)amino]phenyl]acetamide
Basic information
- CAS
21678-64-8- Standard SMILES
CC(=O)Nc1cccc(N(CCC#N)CCC#N)c1- InChIKey
WDZNAWTYQUZIPL-UHFFFAOYSA-N- Molecular formula
- C14H16N4O
- Average molar mass
- 256.3 g/mol
- Monoisotopic mass
- 256.13241115
Names & identifiers
- Preferred name
- N-[3-[Bis(2-cyanoethyl)amino]phenyl]acetamide
- IUPAC
- N-[3-[bis(2-cyanoethyl)amino]phenyl]acetamide
- English name
- N-(3-(Bis(2-cyanoethyl)amino)phenyl)acetamide
- Molecular formula
- C14H16N4O
- Molecular weight
- 256.3
Names & synonyms
21678-64-8N-[3-[bis(2-cyanoethyl)amino]phenyl]acetamideN-(3-(Bis(2-cyanoethyl)amino)phenyl)acetamideEINECS 244-523-4RefChem:161880244-523-4Acetamide,N-[3-[bis(2-cyanoethyl)amino]phenyl]-SCHEMBL10383523DTXSID70944280WDZNAWTYQUZIPL-UHFFFAOYSA-NAKOS015890489NS00050445
Show more names
3-(N,N-DICYANO)AMINO ACETANILINE3-(N,N-DICYANOETHYL)AMINO ACETANILIDEAcetamide, N-[3-[bis(2-cyanoethyl)amino]phenyl]-1-[4-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]sulfonylphenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine dihydrochloride
N-{3-[Bis(2-cyanoethyl)amino]phenyl}ethanimidic acid
Database identifiers
- CAS
21678-64-8- PubChem CID
- 89011
- DTXSID
DTXSID70944280- EC Number
- 244-523-4
- Nikkaji
- J225.413A
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 79.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 369
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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