2,6-dinaphthalen-1-yloxypyridin-4-amine

C25H18N2O2 — CID 59962167

IUPAC2,6-dinaphthalen-1-yloxypyridin-4-amine
SMILESNc1cc(Oc2cccc3ccccc23)nc(Oc2cccc3ccccc23)c1
InChIInChI=1S/C25H18N2O2/c26-19-15-24(28-22-13-5-9-17-7-1-3-11-20(17)22)27-25(16-19)29-23-14-6-10-18-8-2-4-12-21(18)23/h1-16H,(H2,26,27)
InChIKeyQNIUIGHWHHLOFX-UHFFFAOYSA-N
MW378.43 g/mol
LogP6.55
Rot. Bonds4

About 2,6-dinaphthalen-1-yloxypyridin-4-amine

2,6-dinaphthalen-1-yloxypyridin-4-amine (PubChem CID 59962167) has the molecular formula C25H18N2O2 and a molecular weight of 378.43 g/mol. Its IUPAC name is 2,6-dinaphthalen-1-yloxypyridin-4-amine.

Molecular Properties

Compound Name2,6-dinaphthalen-1-yloxypyridin-4-amine
PubChem CID59962167
Molecular FormulaC25H18N2O2
Molecular Weight378.43 g/mol
Exact Mass378.14
IUPAC Name2,6-dinaphthalen-1-yloxypyridin-4-amine
SMILESNc1cc(Oc2cccc3ccccc23)nc(Oc2cccc3ccccc23)c1
InChIInChI=1S/C25H18N2O2/c26-19-15-24(28-22-13-5-9-17-7-1-3-11-20(17)22)27-25(16-19)29-23-14-6-10-18-8-2-4-12-21(18)23/h1-16H,(H2,26,27)
InChIKeyQNIUIGHWHHLOFX-UHFFFAOYSA-N
XLogP6.55
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.43
LogP ≤ 56.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dinaphthalen-1-yloxypyridin-4-amine?
The IUPAC name of 2,6-dinaphthalen-1-yloxypyridin-4-amine (CID 59962167) is 2,6-dinaphthalen-1-yloxypyridin-4-amine.
What is the SMILES notation for 2,6-dinaphthalen-1-yloxypyridin-4-amine?
The canonical SMILES for 2,6-dinaphthalen-1-yloxypyridin-4-amine is Nc1cc(Oc2cccc3ccccc23)nc(Oc2cccc3ccccc23)c1.
What is the InChIKey of 2,6-dinaphthalen-1-yloxypyridin-4-amine?
The InChIKey is QNIUIGHWHHLOFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18N2O2/c26-19-15-24(28-22-13-5-9-17-7-1-3-11-20(17)22)27-25(16-19)29-23-14-6-10-18-8-2-4-12-21(18)23/h1-16H,(H2,26,27).
What are the key properties of 2,6-dinaphthalen-1-yloxypyridin-4-amine?
2,6-dinaphthalen-1-yloxypyridin-4-amine has a molecular weight of 378.43 g/mol, XLogP of 6.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dinaphthalen-1-yloxypyridin-4-amine is sourced from PubChem (CID 59962167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).