N4-(6-Methoxy-4-methyl-quinolin-8-yl)-pentane-1,4-diamine
Basic information
- CAS
57514-30-4- Standard SMILES
COc1cc(NC(C)CCCN)c2nccc(C)c2c1- InChIKey
QISCTRCBADUWSD-UHFFFAOYSA-N- Molecular formula
- C16H23N3O
- Average molar mass
- 273.37 g/mol
- Monoisotopic mass
- 273.18411237
Names & identifiers
- Preferred name
- N4-(6-Methoxy-4-methyl-quinolin-8-yl)-pentane-1,4-diamine
- IUPAC
- 4-N-(6-methoxy-4-methylquinolin-8-yl)pentane-1,4-diamine
Names & synonyms
N4-(6-Methoxy-4-methyl-quinolin-8-yl)-pentane-1,4-diamine57514-30-4NSC305805CHEMBL276256DTXSID80332432NCI60_002597DS-002369N4-(6-methoxy-4-methyl-8-quinolyl)pentane-1,4-diamineN~4~-(6-Methoxy-4-methylquinolin-8-yl)pentane-1,4-diamine
Database identifiers
- CAS
57514-30-4- PubChem CID
- 456586
- DTXSID
DTXSID80332432- ChEMBL
CHEMBL276256- Nikkaji
- J557.317C
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 60.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 287
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Compound notes
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