6-pyridin-2-yl-N-(3-pyridin-2-ylphenyl)pyridin-2-amine

C21H16N4 — CID 161281145

IUPAC6-pyridin-2-yl-N-(3-pyridin-2-ylphenyl)pyridin-2-amine
SMILESc1ccc(-c2cccc(Nc3cccc(-c4ccccn4)n3)c2)nc1
InChIInChI=1S/C21H16N4/c1-3-13-22-18(9-1)16-7-5-8-17(15-16)24-21-12-6-11-20(25-21)19-10-2-4-14-23-19/h1-15H,(H,24,25)
InChIKeyKSPJPHVDIAWJSQ-UHFFFAOYSA-N
MW324.39 g/mol
LogP4.95
Rot. Bonds4

About 6-pyridin-2-yl-N-(3-pyridin-2-ylphenyl)pyridin-2-amine

6-pyridin-2-yl-N-(3-pyridin-2-ylphenyl)pyridin-2-amine (PubChem CID 161281145) has the molecular formula C21H16N4 and a molecular weight of 324.39 g/mol. Its IUPAC name is 6-pyridin-2-yl-N-(3-pyridin-2-ylphenyl)pyridin-2-amine.

Molecular Properties

Compound Name6-pyridin-2-yl-N-(3-pyridin-2-ylphenyl)pyridin-2-amine
PubChem CID161281145
Molecular FormulaC21H16N4
Molecular Weight324.39 g/mol
Exact Mass324.14
IUPAC Name6-pyridin-2-yl-N-(3-pyridin-2-ylphenyl)pyridin-2-amine
SMILESc1ccc(-c2cccc(Nc3cccc(-c4ccccn4)n3)c2)nc1
InChIInChI=1S/C21H16N4/c1-3-13-22-18(9-1)16-7-5-8-17(15-16)24-21-12-6-11-20(25-21)19-10-2-4-14-23-19/h1-15H,(H,24,25)
InChIKeyKSPJPHVDIAWJSQ-UHFFFAOYSA-N
XLogP4.95
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.39
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-pyridin-2-yl-N-(3-pyridin-2-ylphenyl)pyridin-2-amine?
The IUPAC name of 6-pyridin-2-yl-N-(3-pyridin-2-ylphenyl)pyridin-2-amine (CID 161281145) is 6-pyridin-2-yl-N-(3-pyridin-2-ylphenyl)pyridin-2-amine.
What is the SMILES notation for 6-pyridin-2-yl-N-(3-pyridin-2-ylphenyl)pyridin-2-amine?
The canonical SMILES for 6-pyridin-2-yl-N-(3-pyridin-2-ylphenyl)pyridin-2-amine is c1ccc(-c2cccc(Nc3cccc(-c4ccccn4)n3)c2)nc1.
What is the InChIKey of 6-pyridin-2-yl-N-(3-pyridin-2-ylphenyl)pyridin-2-amine?
The InChIKey is KSPJPHVDIAWJSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N4/c1-3-13-22-18(9-1)16-7-5-8-17(15-16)24-21-12-6-11-20(25-21)19-10-2-4-14-23-19/h1-15H,(H,24,25).
What are the key properties of 6-pyridin-2-yl-N-(3-pyridin-2-ylphenyl)pyridin-2-amine?
6-pyridin-2-yl-N-(3-pyridin-2-ylphenyl)pyridin-2-amine has a molecular weight of 324.39 g/mol, XLogP of 4.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-pyridin-2-yl-N-(3-pyridin-2-ylphenyl)pyridin-2-amine is sourced from PubChem (CID 161281145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).