Basic information
- Standard SMILES
CC1=NC2(CCOc3ccc(N)cc32)N=C1N- InChIKey
BLVGFLJUVIRTQR-UHFFFAOYSA-N- Molecular formula
- C12H14N4O
- Average molar mass
- 230.27 g/mol
Names & identifiers
- Preferred name
- 5'-Methylspiro[chromane-4,2'-imidazole]-4',6-diamine
- IUPAC
- 5'-methylspiro[2,3-dihydrochromene-4,2'-imidazole]-4',6-diamine
Names & synonyms
5'-METHYLSPIRO[CHROMANE-4,2'-IMIDAZOLE]-4',6-DIAMINE1383985-11-2SCHEMBL9948052BLVGFLJUVIRTQR-UHFFFAOYSA-N5'-Methylspiro[chroman-4,2'-imidazole]-4',6-diamine
Database identifiers
- PubChem CID
- 67979407
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 86 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 392
Related reactions
31 records
Compound notes
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