N-Bicyclo[2.2.1]hept-2-yl-2-(5-p-tolyl-tetrazol-2-yl)-acetamide
Basic information
- CAS
5173-98-8- Standard SMILES
Cc1ccc(-c2nnn(CC(=O)NC3CC4CCC3C4)n2)cc1- InChIKey
VYKFMVZLUZZVBZ-UHFFFAOYSA-N- Molecular formula
- C17H21N5O
- Average molar mass
- 311.4 g/mol
- Monoisotopic mass
- 311.17461031
Names & identifiers
- Preferred name
- N-Bicyclo[2.2.1]hept-2-yl-2-(5-p-tolyl-tetrazol-2-yl)-acetamide
- IUPAC
- N-(2-bicyclo[2.2.1]heptanyl)-2-[5-(4-methylphenyl)tetrazol-2-yl]acetamide
Names & synonyms
5173-98-8BAS 05829411N-Bicyclo[2.2.1]hept-2-yl-2-(5-p-tolyl-tetrazol-2-yl)-acetamideN-(2-bicyclo[2.2.1]heptanyl)-2-[5-(4-methylphenyl)tetrazol-2-yl]acetamideSMR000013480MLS000031868MLS002535535CHEMBL1386621DTXSID20349544HMS2341F03AKOS000655811NCGC00032207-02
Show more names
ST061457SR-01000362387SR-01000362387-1N-(Bicyclo[2.2.1]heptan-2-yl)-2-[5-(4-methylphenyl)-2H-tetrazol-2-yl]acetamideN-bicyclo[2.2.1]hept-2-yl-2-[5-(4-methylphenyl)(1,2,3,4-tetraazol-2-yl)]acetam ide
Database identifiers
- CAS
5173-98-8- PubChem CID
- 652195
- DTXSID
DTXSID20349544- ChEMBL
CHEMBL1386621
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 72.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 437
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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