Basic information
- CAS
919099-34-6- Standard SMILES
Nc1ccc2c(n1)CCNCC2- InChIKey
INLIXCQKEFDGCC-UHFFFAOYSA-N- Molecular formula
- C9H13N3
- Average molar mass
- 163.22 g/mol
- Monoisotopic mass
- 163.11094743
Names & identifiers
- Preferred name
- 6,7,8,9-Tetrahydro-5h-pyrido[2,3-d]azepin-2-amine
- IUPAC
- 6,7,8,9-tetrahydro-5H-pyrido[2,3-d]azepin-2-amine
Names & synonyms
919099-34-66,7,8,9-tetrahydro-5h-pyrido[2,3-d]azepin-2-amineSCHEMBL2080131DTXSID10648073
Database identifiers
- CAS
919099-34-6- PubChem CID
- 24959639
- DTXSID
DTXSID10648073
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 50.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 149
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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