Basic information
- CAS
100908-65-4- Standard SMILES
CC[NH+](CC)CCN(Cc1cc[nH+]cc1)C(=O)/C=C/c1ccccc1.[Cl-].[Cl-]- InChIKey
MXVSFRKKMITJQT-BGNBUWATSA-N- Molecular formula
- C21H29Cl2N3O
- Average molar mass
- 410.4 g/mol
- Monoisotopic mass
- 409.1687679
Names & identifiers
- Preferred name
- Cinnamamide, N-(2-(diethylamino)ethyl)-N-(4-pyridylmethyl)-, dihydrochloride
- IUPAC
- diethyl-[2-[[(E)-3-phenylprop-2-enoyl]-(pyridin-1-ium-4-ylmethyl)amino]ethyl]azanium dichloride
- English name
- N-(4-Piridinmetil)-N-beta-dietilamminoetilcinnamammide dicloridrato [I talian]
- Molecular formula
- C21H27N3O.2ClH
- Molecular weight
- 410.386
Names & synonyms
100908-65-4CINNAMAMIDE, N-(2-(DIETHYLAMINO)ETHYL)-N-(4-PYRIDYLMETHYL)-, DIHYDROCHLORIDERefChem:1081667N-(2-(Diethylamino)ethyl)-N-(4-pyridylmethyl)cinnamamide dihydrochlorideN-(4-Piridinmetil)-N-beta-dietilamminoetilcinnamammide dicloridrato [Italian]2-Propenamide, N-(2-(diethylamino)ethyl)-3-phenyl-N-(4-pyridinylmethyl)-, dihydrochlorideN-(4-Piridinmetil)-N-beta-dietilamminoetilcinnamammide dicloridratoN-(4-Piridinmetil)-N-beta-dietilamminoetilcinnamammide dicloridrato [I talian]
Database identifiers
- CAS
100908-65-4- PubChem CID
- 6435637
Properties
Computed structural properties
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 394
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…