Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCC(C)(C(=O)Nc2cccc(-c3nnn[nH]3)c2)CC1- InChIKey
HOPNTIROJCWNIZ-UHFFFAOYSA-N- Molecular formula
- C19H26N6O3
- Average molar mass
- 386.4 g/mol
- Monoisotopic mass
- 386.20663871
Names & identifiers
- Preferred name
- tert-butyl 4-(3-(1H-tetrazol-5-yl)phenylcarbamoyl)-4-methylpiperidine-1-carboxylate
- IUPAC
- tert-butyl 4-methyl-4-[[3-(2H-tetrazol-5-yl)phenyl]carbamoyl]piperidine-1-carboxylate
Names & synonyms
SCHEMBL4302106HOPNTIROJCWNIZ-UHFFFAOYSA-Ntert-butyl 4-(3-(1H-tetrazol-5-yl) phenylcarbamoyl)-4-methylpiperidine-1-carboxylatetert-butyl 4-(3-(1H-tetrazol-5-yl)phenylcarbamoyl)-4-methylpiperidine-1-carboxylate
Database identifiers
- PubChem CID
- 68993973
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 571
Related reactions
5 records
Compound notes
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