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4-Quinolinamine, N-(1,1-dimethylethyl)-2-phenyl-

HCID 453045
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
128924-95-8
Standard SMILES
CC(C)(C)Nc1cc(-c2ccccc2)nc2ccccc12
InChIKey
FVPJOMUUSSQZKZ-UHFFFAOYSA-N
Molecular formula
C19H20N2
Average molar mass
276.4 g/mol
Monoisotopic mass
276.16264865

Names & identifiers

Preferred name
4-Quinolinamine, N-(1,1-dimethylethyl)-2-phenyl-
IUPAC
N-tert-butyl-2-phenylquinolin-4-amine

Names & synonyms

N-tert-Butyl-2-phenylquinolin-4-amine128924-95-84-Quinolinamine, N-(1,1-dimethylethyl)-2-phenyl-DTXSID50156006RefChem:296238DTXCID6078497N-(tert-Butyl)-2-phenylquinolin-4-amineCHEMBL297128FVPJOMUUSSQZKZ-UHFFFAOYSA-NN-tert-butyl-2-phenyl-quinolin-4-amineN-(tert-butyl)-2-phenyl-4-quinolinamineN-[1,1-Dimethylethyl)ethyl]-2-phenyl-4-quinolinamine

Database identifiers

CAS
128924-95-8
PubChem CID
453045
DTXSID
DTXSID50156006
ChEMBL
CHEMBL297128
Nikkaji
J331.462F

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
24.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
21
Formal charge
0
Complexity
327

Related reactions

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Compound notes

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