Basic information
- CAS
74440-54-3- Standard SMILES
O=[N+]([O-])c1cc(CN2CCCCC2)c(O)c2ncccc12- InChIKey
AMBGTNKKOSVECG-UHFFFAOYSA-N- Molecular formula
- C15H17N3O3
- Average molar mass
- 287.31 g/mol
- Monoisotopic mass
- 287.12699141
Names & identifiers
- Preferred name
- 8-Quinolinol, 5-nitro-7-(1-piperidinylmethyl)-
- IUPAC
- 5-nitro-7-(piperidin-1-ylmethyl)quinolin-8-ol
Names & synonyms
8-Quinolinol, 5-nitro-7-(1-piperidinylmethyl)-74440-54-35-Nitro-7-(1-piperidinylmethyl)-8-quinolinolOprea1_868184SCHEMBL4461212CHEMBL2407601DTXSID002254535-Nitro-7-[(piperidin-1-yl)methyl]quinolin-8-olAG-205/11554759SR-01000522147SR-01000522147-1
Database identifiers
- CAS
74440-54-3- PubChem CID
- 150799
- DTXSID
DTXSID00225453- ChEMBL
CHEMBL2407601
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 82.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 368
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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