Basic information
- CAS
1774896-56-8- Standard SMILES
CC1CCCCN1c1ccc(NC(=O)c2cccc(I)c2)cc1N- InChIKey
DWBPZXYFQXWUNU-UHFFFAOYSA-N- Molecular formula
- C19H22IN3O
- Average molar mass
- 435.3 g/mol
- Monoisotopic mass
- 435.08076
Names & identifiers
- Preferred name
- N-[3-amino-4-(2-methylpiperidin-1-yl)phenyl]-3-iodobenzamide
- IUPAC
- N-[3-amino-4-(2-methylpiperidin-1-yl)phenyl]-3-iodobenzamide
Names & synonyms
N-[3-amino-4-(2-methylpiperidin-1-yl)phenyl]-3-iodobenzamideDTXSID501175239AKOS025125414Benzamide, N-[3-amino-4-(2-methyl-1-piperidinyl)phenyl]-3-iodo-1774896-56-8
Database identifiers
- CAS
1774896-56-8- PubChem CID
- 91676366
- DTXSID
DTXSID501175239
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 433
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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