Basic information
- CAS
167015-16-9- Standard SMILES
NCCCN(CC(=O)O)Cc1ccccc1- InChIKey
DPMFDDQYBMDPFT-UHFFFAOYSA-N- Molecular formula
- C12H18N2O2
- Average molar mass
- 222.28 g/mol
- Monoisotopic mass
- 222.13682782
Names & identifiers
- Preferred name
- N-(3-Aminopropyl)-N-(phenylmethyl)glycine
- IUPAC
- 2-[3-aminopropyl(benzyl)amino]acetic acid
Names & synonyms
N-(3-Aminopropyl)-N-(phenylmethyl)glycineSCHEMBL8961275DTXSID101270724N-(3-Aminopropyl)-N-benzylglycine167015-16-9
Database identifiers
- CAS
167015-16-9- PubChem CID
- 53772308
- DTXSID
DTXSID101270724
Properties
Computed structural properties
- XLogP
- -1.5
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 203
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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