Basic information
- CAS
7472-74-4- Standard SMILES
Cc1ccc(NC(=O)C2CCCN2C(=O)OCc2ccccc2)cc1- InChIKey
LMHYRONRSGZPTM-UHFFFAOYSA-N- Molecular formula
- C20H22N2O3
- Average molar mass
- 338.4 g/mol
- Monoisotopic mass
- 338.16304257
Names & identifiers
- Preferred name
- Benzyl 2-[(4-methylphenyl)carbamoyl]pyrrolidine-1-carboxylate
- IUPAC
- benzyl 2-[(4-methylphenyl)carbamoyl]pyrrolidine-1-carboxylate
Names & synonyms
Benzyl 2-(p-tolylcarbamoyl)pyrrolidine-1-carboxylate7472-74-4benzyl 2-[(4-methylphenyl)carbamoyl]pyrrolidine-1-carboxylateNSC402051Oprea1_295350SCHEMBL12755446DTXSID80322797LMHYRONRSGZPTM-UHFFFAOYSA-NHTS03273AKOS001733061NSC-402051CS-0101524
Show more names
D76182SR-01000509631SR-01000509631-1Benzyl 2-(4-toluidinocarbonyl)-1-pyrrolidinecarboxylate #Pyrrolidine-2-carboxamide, 1-benzyloxycarbonyl-N-(4-tolyl)-
Database identifiers
- CAS
7472-74-4- PubChem CID
- 344902
- DTXSID
DTXSID80322797
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 454
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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