Basic information
- CAS
22636-29-9- Standard SMILES
CCOc1ccc(NC(C)=O)cc1N(CCO)CCC#N- InChIKey
RMCDTZNXPUSKTQ-UHFFFAOYSA-N- Molecular formula
- C15H21N3O3
- Average molar mass
- 291.35 g/mol
- Monoisotopic mass
- 291.15829154
Names & identifiers
- Preferred name
- Acetamide, N-[3-[(2-cyanoethyl)(2-hydroxyethyl)amino]-4-ethoxyphenyl]-
- IUPAC
- N-[3-[2-cyanoethyl(2-hydroxyethyl)amino]-4-ethoxyphenyl]acetamide
- English name
- N-[3-[(2-Cyanoethyl)(2-hydroxyethyl)amino]-4-ethoxyphenyl]acetamide
- Molecular formula
- C15H21N3O3
- Molecular weight
- 291.35
Names & synonyms
Acetamide, N-(3-((2-cyanoethyl)(2-hydroxyethyl)amino)-4-ethoxyphenyl)-DTXSID1066817Acetamide, N-[3-[(2-cyanoethyl)(2-hydroxyethyl)amino]-4-ethoxyphenyl]-RefChem:551828DTXCID803673422636-29-9n-{3-[(2-cyanoethyl)(2-hydroxyethyl)amino]-4-ethoxyphenyl}acetamideSCHEMBL11517261RMCDTZNXPUSKTQ-UHFFFAOYSA-NN-[3-[(2-Cyanoethyl)(2-hydroxyethyl)amino]-4-ethoxyphenyl]acetamide
Database identifiers
- CAS
22636-29-9- PubChem CID
- 89780
- DTXSID
DTXSID1066817- Nikkaji
- J422.100A
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 85.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 366
Physicochemical properties
- EPA Substance Registry System
- 3 · Acetamide, N-[3-[(2-cyanoethyl)(2-hydroxyethyl)amino]-4-ethoxyphenyl]- (22636-29-9)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationAcetamide, N-[3-[(2-cyanoethyl)(2-hydroxyethyl)amino]-4-ethoxyphenyl]-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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