Basic information
- CAS
199433-57-3- Standard SMILES
C[C@@H](N)c1ccc(C(=O)Nc2ccncc2)cc1- InChIKey
LLSFXOUAPAZFIV-SNVBAGLBSA-N- Molecular formula
- C14H15N3O
- Average molar mass
- 241.29 g/mol
- Monoisotopic mass
- 241.12151211
Names & identifiers
- Preferred name
- Benzamide, 4-[(1R)-1-aminoethyl]-N-4-pyridinyl-
- IUPAC
- 4-[(1R)-1-aminoethyl]-N-pyridin-4-ylbenzamide
- English name
- Benzamide, 4-[(1R)-1-aminoethyl]-N-4-pyridinyl-
- Molecular formula
- C14H15N3O
- Molecular weight
- 241.29
Names & synonyms
199433-57-3(R)-4-(1-Aminoethyl)-N-(pyridin-4-yl)benzamideBenzamide, 4-[(1R)-1-aminoethyl]-N-4-pyridinyl-CHEMBL3040797CHEMBL24192784-[(1R)-1-aminoethyl]-N-(pyridin-4-yl)benzamideSCHEMBL1553349DTXSID70431761BDBM50496767BDBM50614302G88853
Database identifiers
- CAS
199433-57-3- PubChem CID
- 9851172
- DTXSID
DTXSID70431761- ChEMBL
CHEMBL2419278、CHEMBL3040797- Nikkaji
- J1.857.566C
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 68 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 268
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers2 total
郑州格镭生物科技有限公司19903857099; 19937938981 · [email protected]
江苏艾康生物医药研发有限公司17714375163 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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