5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-3-amine

C15H10Br2N2O — CID 103518685

IUPAC5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-3-amine
SMILESNc1cncc(Br)c1Oc1ccc2cc(Br)ccc2c1
InChIInChI=1S/C15H10Br2N2O/c16-11-3-1-10-6-12(4-2-9(10)5-11)20-15-13(17)7-19-8-14(15)18/h1-8H,18H2
InChIKeyFFCDSFBUQPOLNS-UHFFFAOYSA-N
MW394.07 g/mol
LogP5.13
Rot. Bonds2

About 5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-3-amine

5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-3-amine (PubChem CID 103518685) has the molecular formula C15H10Br2N2O and a molecular weight of 394.07 g/mol. Its IUPAC name is 5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-3-amine.

Molecular Properties

Compound Name5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-3-amine
PubChem CID103518685
Molecular FormulaC15H10Br2N2O
Molecular Weight394.07 g/mol
Exact Mass391.92
IUPAC Name5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-3-amine
SMILESNc1cncc(Br)c1Oc1ccc2cc(Br)ccc2c1
InChIInChI=1S/C15H10Br2N2O/c16-11-3-1-10-6-12(4-2-9(10)5-11)20-15-13(17)7-19-8-14(15)18/h1-8H,18H2
InChIKeyFFCDSFBUQPOLNS-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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Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-3-amine?
The IUPAC name of 5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-3-amine (CID 103518685) is 5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-3-amine.
What is the SMILES notation for 5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-3-amine?
The canonical SMILES for 5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-3-amine is Nc1cncc(Br)c1Oc1ccc2cc(Br)ccc2c1.
What is the InChIKey of 5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-3-amine?
The InChIKey is FFCDSFBUQPOLNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Br2N2O/c16-11-3-1-10-6-12(4-2-9(10)5-11)20-15-13(17)7-19-8-14(15)18/h1-8H,18H2.
What are the key properties of 5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-3-amine?
5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-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 5-bromo-4-(6-bromonaphthalen-2-yl)oxypyridin-3-amine is sourced from PubChem (CID 103518685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).