Basic information
- CAS
3815-69-8- Standard SMILES
NC(=O)c1ncn(Cc2ccccc2)c1N- InChIKey
JAODJMVGFQELNO-UHFFFAOYSA-N- Molecular formula
- C11H12N4O
- Average molar mass
- 216.24 g/mol
- Monoisotopic mass
- 216.10111102
Names & identifiers
- Preferred name
- 5-Amino-1-benzylimidazole-4-carboxamide
- IUPAC
- 5-amino-1-benzylimidazole-4-carboxamide
Names & synonyms
3815-69-85-amino-1-benzylimidazole-4-carboxamideDTXSID70355695RefChem:300892DTXCID803067545-amino-1-benzyl-1H-imidazole-4-carboxamide1H-Imidazole-4-carboxamide, 5-amino-1-(phenylmethyl)-1-benzyl-5-aminoimidazole-4-carboxamideSCHEMBL9367365AKOS015905616AA-516/25012201AF-399/34014005
Database identifiers
- CAS
3815-69-8- PubChem CID
- 816719
- DTXSID
DTXSID70355695
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 86.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 252
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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