Basic information
- Standard SMILES
CC1(C)CC(N)c2cc(C#N)ccc2O1- InChIKey
LMUHXVBASKTZGP-UHFFFAOYSA-N- Molecular formula
- C12H14N2O
- Average molar mass
- 202.25 g/mol
Names & identifiers
- Preferred name
- 4-Amino-6-cyano-3,4-dihydro-2,2-dimethyl-2H-1-benzopyran
- IUPAC
- 4-amino-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile
Names & synonyms
SCHEMBL6494278LMUHXVBASKTZGP-UHFFFAOYSA-N4-Amino-6-cyano-3,4-dihydro-2,2-dimethyl-2H-1benzopyran4-Amino-6-cyano-3,4-dihydro-2,2-dimethyl-2H-1-benzopyran
Database identifiers
- PubChem CID
- 11820163
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 291
Related reactions
2 records
Compound notes
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