1-(tert-Butoxycarbonyl)-4-(pyridin-4-yl)piperidine-4-carboxylic acid
Completing data — refresh the page later to see the latest
Basic information
- CAS
167262-95-5- Standard SMILES
CC(C)(C)OC(=O)N1CCC(C(=O)O)(c2ccncc2)CC1- InChIKey
ZURDRHAPGPNQOT-UHFFFAOYSA-N- Molecular formula
- C16H22N2O4
- Average molar mass
- 306.36 g/mol
- Monoisotopic mass
- 306.15795718
Names & identifiers
- Preferred name
- 1-(tert-Butoxycarbonyl)-4-(pyridin-4-yl)piperidine-4-carboxylic acid
- IUPAC
- 1-[(2-methylpropan-2-yl)oxycarbonyl]-4-pyridin-4-ylpiperidine-4-carboxylic acid
Names & synonyms
167262-95-51-(tert-Butoxycarbonyl)-4-(pyridin-4-yl)piperidine-4-carboxylic acidSCHEMBL8352820DTXSID60712258ZURDRHAPGPNQOT-UHFFFAOYSA-N1-(tert-Butoxycarbonyl)-4-(pyridin-4-yl)piperidine-4-carboxylicacidAT24652DA-305491-tert-butoxycarbonyl-4-(pyridin-4-yl)-piperidine-4-carboxylic acid
Database identifiers
- CAS
167262-95-5- PubChem CID
- 54567191
- DTXSID
DTXSID60712258
Properties
Computed structural propertiesFilling in
- XLogP
- 1.5
- Topological polar surface area
- 79.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 416
Related reactions
2 records
Compound notes
Loading…