Completing data — usually done within a minute
Basic information
- CAS
91188-27-1- Standard SMILES
CCn1cc(C(=O)O)c(=O)c2cc(F)c(N3CCC4(CCN(C)C4)C3)nc21- InChIKey
DAUQIWGEPVCCFO-UHFFFAOYSA-N- Molecular formula
- C19H23FN4O3
- Average molar mass
- 374.4 g/mol
- Monoisotopic mass
- 374.17541882
Names & identifiers
- Preferred name
- 1-Ethyl-6-fluoro-7-(3-methyl-3,8-diazaspiro[4.4]nonan-8-yl)-4-oxo-1,8-naphthyridine-3-carboxylic acid
- IUPAC
- 1-ethyl-6-fluoro-7-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)-4-oxo-1,8-naphthyridine-3-carboxylic acid
Names & synonyms
1-Ethyl-6-fluoro-1,4-dihydro-7-(7-methyl-2,7-diazaspiro[4.4]non-2-yl)-4-oxo-1,8-naphthyridine-3-carboxylic acidPD 1145071-ethyl-6-fluoro-7-(3-methyl-3,8-diazaspiro[4.4]nonan-8-yl)-4-oxo-1,8-naphthyridine-3-carboxylic acidCHEMBL73955SCHEMBL9645766DAUQIWGEPVCCFO-UHFFFAOYSA-NDTXSID80110786391188-27-11,8-Naphthyridine-3-carboxylic acid, 1-ethyl-6-fluoro-1,4-dihydro-7-(7-methyl-2,7-diazaspiro[4.4]non-2-yl)-4-oxo-
Database identifiers
- CAS
91188-27-1- PubChem CID
- 461885
- DTXSID
DTXSID801107863- ChEMBL
CHEMBL73955- Nikkaji
- J336.874B
Properties
Computed structural propertiesFilling in
- XLogP
- 0.9
- Topological polar surface area
- 77 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 671
Related reactions
5 records
Compound notes
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