6-bromo-4-(3-bromophenoxy)quinolin-3-amine

C15H10Br2N2O — CID 43621410

IUPAC6-bromo-4-(3-bromophenoxy)quinolin-3-amine
SMILESNc1cnc2ccc(Br)cc2c1Oc1cccc(Br)c1
InChIInChI=1S/C15H10Br2N2O/c16-9-2-1-3-11(6-9)20-15-12-7-10(17)4-5-14(12)19-8-13(15)18/h1-8H,18H2
InChIKeyAKILUKHURNRRBJ-UHFFFAOYSA-N
MW394.07 g/mol
LogP5.13
Rot. Bonds2

About 6-bromo-4-(3-bromophenoxy)quinolin-3-amine

6-bromo-4-(3-bromophenoxy)quinolin-3-amine (PubChem CID 43621410) has the molecular formula C15H10Br2N2O and a molecular weight of 394.07 g/mol. Its IUPAC name is 6-bromo-4-(3-bromophenoxy)quinolin-3-amine.

Molecular Properties

Compound Name6-bromo-4-(3-bromophenoxy)quinolin-3-amine
PubChem CID43621410
Molecular FormulaC15H10Br2N2O
Molecular Weight394.07 g/mol
Exact Mass391.92
IUPAC Name6-bromo-4-(3-bromophenoxy)quinolin-3-amine
SMILESNc1cnc2ccc(Br)cc2c1Oc1cccc(Br)c1
InChIInChI=1S/C15H10Br2N2O/c16-9-2-1-3-11(6-9)20-15-12-7-10(17)4-5-14(12)19-8-13(15)18/h1-8H,18H2
InChIKeyAKILUKHURNRRBJ-UHFFFAOYSA-N
XLogP5.13
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.07
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-bromo-4-phenoxyquinolin-3-amine
CID 43621409
6-bromo-4-(1-propylpyrazol-4-yl)oxyquinolin-3-amine
CID 116800405
6-bromo-4-(2-fluoro-5-methylphenoxy)quinolin-3-amine
CID 64854002
6-bromo-4-[(3-chlorophenyl)methoxy]quinolin-3-amine
CID 65126875
5-bromo-2-(3-bromophenoxy)pyridin-3-amine
CID 61228290
6-bromo-4-[3-(dimethylamino)propoxy]quinolin-3-amine
CID 61102494
4-(4-bromo-2-methylphenoxy)quinolin-3-amine
CID 103963717
4-(4-bromo-3-methylphenoxy)quinolin-3-amine
CID 103963762
5-bromo-2-(3-bromophenoxy)aniline
CID 29030936
4-(3-bromophenoxy)-3-nitroquinoline
CID 103963835
4-[3-(methoxymethyl)phenoxy]quinolin-3-amine
CID 103963726
2-(3-bromophenoxy)pyridin-3-amine
CID 16782330

Frequently Asked Questions

What is the IUPAC name of 6-bromo-4-(3-bromophenoxy)quinolin-3-amine?
The IUPAC name of 6-bromo-4-(3-bromophenoxy)quinolin-3-amine (CID 43621410) is 6-bromo-4-(3-bromophenoxy)quinolin-3-amine.
What is the SMILES notation for 6-bromo-4-(3-bromophenoxy)quinolin-3-amine?
The canonical SMILES for 6-bromo-4-(3-bromophenoxy)quinolin-3-amine is Nc1cnc2ccc(Br)cc2c1Oc1cccc(Br)c1.
What is the InChIKey of 6-bromo-4-(3-bromophenoxy)quinolin-3-amine?
The InChIKey is AKILUKHURNRRBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Br2N2O/c16-9-2-1-3-11(6-9)20-15-12-7-10(17)4-5-14(12)19-8-13(15)18/h1-8H,18H2.
What are the key properties of 6-bromo-4-(3-bromophenoxy)quinolin-3-amine?
6-bromo-4-(3-bromophenoxy)quinolin-3-amine has a molecular weight of 394.07 g/mol, XLogP of 5.13, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-4-(3-bromophenoxy)quinolin-3-amine is sourced from PubChem (CID 43621410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).