Basic information
- CAS
73855-89-7- Standard SMILES
NCC1CN(C2c3ccccc3CCc3ccccc32)C1- InChIKey
NIJTYTBBOAANFT-UHFFFAOYSA-N- Molecular formula
- C19H22N2
- Average molar mass
- 278.4 g/mol
- Monoisotopic mass
- 278.17829871
Names & identifiers
- Preferred name
- Azetidine, 1-(10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-yl)-3-aminomethyl-
- IUPAC
- [1-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)azetidin-3-yl]methanamine
- English name
- [1-[10,11-Dihydro-5H-dibenzo[a,d]cyclohepten-5-yl]-3-azetidinyl]methylamine
- Molecular formula
- C19H22N2
- Molecular weight
- 278.39
Names & synonyms
BRN 048898473855-89-71-(10,11-Dihydro-5H-dibenzo(a,d)cyclohepten-5-yl)-3-aminomethylazetidine5-22-08-00024 (Beilstein Handbook Reference)AZETIDINE, 1-(10,11-DIHYDRO-5H-DIBENZO(a,d)CYCLOHEPTEN-5-YL)-3-AMINOMETHYL-RefChem:320319CHEMBL3230887DTXSID809950061-[1-(10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-yl)azetidin-3-yl]methanamine3-Azetidinemethanamine, 1-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)-[1-[10,11-Dihydro-5H-dibenzo[a,d]cyclohepten-5-yl]-3-azetidinyl]methylamine
Database identifiers
- CAS
73855-89-7- PubChem CID
- 52679
- DTXSID
DTXSID80995006- ChEMBL
CHEMBL3230887- Nikkaji
- J84.679A
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 325
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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