N-(5,6-Diethoxy-1H-benzimidazol-2-yl)propanamide
Basic information
- CAS
40722-30-3- Standard SMILES
CCOc1cc2nc(NC(=O)CC)[nH]c2cc1OCC- InChIKey
ZMWHYLBPHFEKTA-UHFFFAOYSA-N- Molecular formula
- C14H19N3O3
- Average molar mass
- 277.32 g/mol
- Monoisotopic mass
- 277.14264148
Names & identifiers
- Preferred name
- N-(5,6-Diethoxy-1H-benzimidazol-2-yl)propanamide
- IUPAC
- N-(5,6-diethoxy-1H-benzimidazol-2-yl)propanamide
- English name
- N-(5,6-Diethoxy-1H-benzimidazol-2-yl)propionamide
- Molecular formula
- C14H19N3O3
- Molecular weight
- 277.32
Names & synonyms
40722-30-3N-(5,6-Diethoxy-1H-benzimidazol-2-yl)propanamideBRN 0674050N-(5,6-Diethoxy-2-benzimidazolyl)propionamidePropanamide, N-(5,6-diethoxy-1H-benzimidazol-2-yl)-Propionamide, N-(5,6-diethoxy-2-benzimidazolyl)-N-(5,6-Diethoxy-1H-benzimidazol-2-yl)propionamideDTXSID70193711Propanamide, N-(5,6-diethoxy-1H-benzimidazol-2-yl)- (9CI)N-(5,6-Diethoxy-1H-1,3-benzimidazol-2-yl)propanamide
Database identifiers
- CAS
40722-30-3- PubChem CID
- 218513
- DTXSID
DTXSID70193711- Nikkaji
- J87.429I
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 76.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 327
Physicochemical properties
- Density
- 1.228 · 1.228±0.06 g/cm3(Predicted)
- pka
- 9.07 · 9.07±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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