2-Pyrrolidinone, 4-amino-1-[(4-methylphenyl)methyl]-
Basic information
- CAS
1114822-39-7- Standard SMILES
Cc1ccc(CN2CC(N)CC2=O)cc1- InChIKey
DRIOZWZFPKFQQC-UHFFFAOYSA-N- Molecular formula
- C12H16N2O
- Average molar mass
- 204.27 g/mol
- Monoisotopic mass
- 204.12626314
Names & identifiers
- Preferred name
- 2-Pyrrolidinone, 4-amino-1-[(4-methylphenyl)methyl]-
- IUPAC
- 4-amino-1-[(4-methylphenyl)methyl]pyrrolidin-2-one
Names & synonyms
2-Pyrrolidinone, 4-amino-1-[(4-methylphenyl)methyl]-DTXSID501217502AKOS0003451981114822-39-74-amino-1-[(4-methylphenyl)methyl]pyrrolidin-2-one
Database identifiers
- CAS
1114822-39-7- PubChem CID
- 20110072
- DTXSID
DTXSID501217502
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 234
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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