6-bromo-4-phenoxyquinolin-3-amine

C15H11BrN2O — CID 43621409

IUPAC6-bromo-4-phenoxyquinolin-3-amine
SMILESNc1cnc2ccc(Br)cc2c1Oc1ccccc1
InChIInChI=1S/C15H11BrN2O/c16-10-6-7-14-12(8-10)15(13(17)9-18-14)19-11-4-2-1-3-5-11/h1-9H,17H2
InChIKeyKIJMBYHAFUDGDI-UHFFFAOYSA-N
MW315.17 g/mol
LogP4.37
Rot. Bonds2

About 6-bromo-4-phenoxyquinolin-3-amine

6-bromo-4-phenoxyquinolin-3-amine (PubChem CID 43621409) has the molecular formula C15H11BrN2O and a molecular weight of 315.17 g/mol. Its IUPAC name is 6-bromo-4-phenoxyquinolin-3-amine.

Molecular Properties

Compound Name6-bromo-4-phenoxyquinolin-3-amine
PubChem CID43621409
Molecular FormulaC15H11BrN2O
Molecular Weight315.17 g/mol
Exact Mass314.01
IUPAC Name6-bromo-4-phenoxyquinolin-3-amine
SMILESNc1cnc2ccc(Br)cc2c1Oc1ccccc1
InChIInChI=1S/C15H11BrN2O/c16-10-6-7-14-12(8-10)15(13(17)9-18-14)19-11-4-2-1-3-5-11/h1-9H,17H2
InChIKeyKIJMBYHAFUDGDI-UHFFFAOYSA-N
XLogP4.37
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.17
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-bromo-4-(3-bromophenoxy)quinolin-3-amine
CID 43621410
6-bromo-4-(1-propylpyrazol-4-yl)oxyquinolin-3-amine
CID 116800405
6-bromo-4-phenylsulfanylquinolin-3-amine
CID 43621472
4-(4-bromo-2-methylphenoxy)quinolin-3-amine
CID 103963717
6-bromo-4-(2-fluoro-5-methylphenoxy)quinolin-3-amine
CID 64854002
6-bromo-4-[(3-chlorophenyl)methoxy]quinolin-3-amine
CID 65126875
2-(3-amino-6-bromoquinolin-4-yl)phenol
CID 174771858
4-(4-bromo-3-methylphenoxy)quinolin-3-amine
CID 103963762
6-bromo-4-[3-(dimethylamino)propoxy]quinolin-3-amine
CID 61102494
6-bromo-4-N-ethyl-4-N-phenylquinoline-3,4-diamine
CID 43621145
4-(4-methylsulfanylphenoxy)quinolin-3-amine
CID 103963721
6-bromo-4-(2-fluorophenyl)sulfanylquinolin-3-amine
CID 43621479

Frequently Asked Questions

What is the IUPAC name of 6-bromo-4-phenoxyquinolin-3-amine?
The IUPAC name of 6-bromo-4-phenoxyquinolin-3-amine (CID 43621409) is 6-bromo-4-phenoxyquinolin-3-amine.
What is the SMILES notation for 6-bromo-4-phenoxyquinolin-3-amine?
The canonical SMILES for 6-bromo-4-phenoxyquinolin-3-amine is Nc1cnc2ccc(Br)cc2c1Oc1ccccc1.
What is the InChIKey of 6-bromo-4-phenoxyquinolin-3-amine?
The InChIKey is KIJMBYHAFUDGDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrN2O/c16-10-6-7-14-12(8-10)15(13(17)9-18-14)19-11-4-2-1-3-5-11/h1-9H,17H2.
What are the key properties of 6-bromo-4-phenoxyquinolin-3-amine?
6-bromo-4-phenoxyquinolin-3-amine has a molecular weight of 315.17 g/mol, XLogP of 4.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-4-phenoxyquinolin-3-amine is sourced from PubChem (CID 43621409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).