Basic information
- Standard SMILES
Cn1nnnc1N1CCC(NC(=O)OC(C)(C)C)CC1- InChIKey
ZFMYSGMEVSOALY-UHFFFAOYSA-N- Molecular formula
- C12H22N6O2
- Average molar mass
- 282.34 g/mol
Names & identifiers
- Preferred name
- tert-butyl[1-(1-methyl-1H-tetrazol-5-yl)-piperidin-4-yl]-carbamate
- IUPAC
- tert-butyl N-[1-(1-methyltetrazol-5-yl)piperidin-4-yl]carbamate
Names & synonyms
SCHEMBL19020818ZFMYSGMEVSOALY-UHFFFAOYSA-NDB-374232tert-butyl[1-(1-methyl-1H-tetrazol-5-yl)-piperidin-4-yl]-carbamate1,1-Dimethylethyl N-[1-(1-methyl-1H-tetrazol-5-yl)-4-piperidinyl]carbamate1033844-93-7
Database identifiers
- PubChem CID
- 91012822
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 85.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 337
Related reactions
2 records
Compound notes
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