Basic information
- Standard SMILES
Nc1cccc(CNC(=O)O[C@H]2CCOC2)c1- InChIKey
IFWYTYQAUPOOCM-NSHDSACASA-N- Molecular formula
- C12H16N2O3
- Average molar mass
- 236.27 g/mol
Names & identifiers
- Preferred name
- (S)-Tetrahydrofuran-3-yl (3-aminobenzyl)carbamate
- IUPAC
- [(3S)-oxolan-3-yl] N-[(3-aminophenyl)methyl]carbamate
Names & synonyms
(S)-Tetrahydrofuran-3-yl (3-aminobenzyl)carbamate267406-34-8(3S)-oxolan-3-yl N-[(3-aminophenyl)methyl]carbamateSCHEMBL13202467IFWYTYQAUPOOCM-NSHDSACASA-NCS-0116135(S)-tetrahydrofuran-3-yl 3-aminobenzylcarbamate
Database identifiers
- PubChem CID
- 59901461
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 73.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 260
Related reactions
2 records
Compound notes
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