N-[2-(2,3,4,5-tetrahydroazepino[4,5-b]indol-6(1H)-yl)ethyl]benzamide hydrochloride
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Basic information
- Standard SMILES
Cl.O=C(NCCn1c2c(c3ccccc31)CCNCC2)c1ccccc1- InChIKey
UQSIHFLYENBJSB-UHFFFAOYSA-N- Molecular formula
- C21H24ClN3O
- Average molar mass
- 369.9 g/mol
Names & identifiers
- Preferred name
- N-[2-(2,3,4,5-tetrahydroazepino[4,5-b]indol-6(1H)-yl)ethyl]benzamide hydrochloride
- IUPAC
- N-[2-(2,3,4,5-tetrahydro-1H-azepino[4,5-b]indol-6-yl)ethyl]benzamide;hydrochloride
Names & synonyms
SCHEMBL6473917UQSIHFLYENBJSB-UHFFFAOYSA-NN-[2-(2,3,4,5-tetrahydroazepino[4,5-b]indol-6(1H)-yl)ethyl]benzamide hydrochloride
Database identifiers
- PubChem CID
- 22396552
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 46.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 448
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Related reactions
2 records
Compound notes
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