5-[(2-pyridin-4-yl-4-pyridinyl)oxy]pyridin-2-amine

C15H12N4O — CID 166069029

IUPAC5-[(2-pyridin-4-yl-4-pyridinyl)oxy]pyridin-2-amine
SMILESNc1ccc(Oc2ccnc(-c3ccncc3)c2)cn1
InChIInChI=1S/C15H12N4O/c16-15-2-1-13(10-19-15)20-12-5-8-18-14(9-12)11-3-6-17-7-4-11/h1-10H,(H2,16,19)
InChIKeyPJLNTERXAHMKBO-UHFFFAOYSA-N
MW264.29 g/mol
LogP2.91
Rot. Bonds3

About 5-[(2-pyridin-4-yl-4-pyridinyl)oxy]pyridin-2-amine

5-[(2-pyridin-4-yl-4-pyridinyl)oxy]pyridin-2-amine (PubChem CID 166069029) has the molecular formula C15H12N4O and a molecular weight of 264.29 g/mol. Its IUPAC name is 5-[(2-pyridin-4-yl-4-pyridinyl)oxy]pyridin-2-amine.

Molecular Properties

Compound Name5-[(2-pyridin-4-yl-4-pyridinyl)oxy]pyridin-2-amine
PubChem CID166069029
Molecular FormulaC15H12N4O
Molecular Weight264.29 g/mol
Exact Mass264.10
IUPAC Name5-[(2-pyridin-4-yl-4-pyridinyl)oxy]pyridin-2-amine
SMILESNc1ccc(Oc2ccnc(-c3ccncc3)c2)cn1
InChIInChI=1S/C15H12N4O/c16-15-2-1-13(10-19-15)20-12-5-8-18-14(9-12)11-3-6-17-7-4-11/h1-10H,(H2,16,19)
InChIKeyPJLNTERXAHMKBO-UHFFFAOYSA-N
XLogP2.91
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[(2-pyridin-4-yl-4-pyridinyl)oxy]pyridin-2-amine?
The IUPAC name of 5-[(2-pyridin-4-yl-4-pyridinyl)oxy]pyridin-2-amine (CID 166069029) is 5-[(2-pyridin-4-yl-4-pyridinyl)oxy]pyridin-2-amine.
What is the SMILES notation for 5-[(2-pyridin-4-yl-4-pyridinyl)oxy]pyridin-2-amine?
The canonical SMILES for 5-[(2-pyridin-4-yl-4-pyridinyl)oxy]pyridin-2-amine is Nc1ccc(Oc2ccnc(-c3ccncc3)c2)cn1.
What is the InChIKey of 5-[(2-pyridin-4-yl-4-pyridinyl)oxy]pyridin-2-amine?
The InChIKey is PJLNTERXAHMKBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O/c16-15-2-1-13(10-19-15)20-12-5-8-18-14(9-12)11-3-6-17-7-4-11/h1-10H,(H2,16,19).
What are the key properties of 5-[(2-pyridin-4-yl-4-pyridinyl)oxy]pyridin-2-amine?
5-[(2-pyridin-4-yl-4-pyridinyl)oxy]pyridin-2-amine has a molecular weight of 264.29 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-pyridin-4-yl-4-pyridinyl)oxy]pyridin-2-amine is sourced from PubChem (CID 166069029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).