2-phenyl-6-pyridin-2-yl-N-pyrimidin-2-ylpyrimidin-4-amine

C19H14N6 — CID 3411544

IUPAC2-phenyl-6-pyridin-2-yl-N-pyrimidin-2-ylpyrimidin-4-amine
SMILESc1ccc(-c2nc(Nc3ncccn3)cc(-c3ccccn3)n2)cc1
InChIInChI=1S/C19H14N6/c1-2-7-14(8-3-1)18-23-16(15-9-4-5-10-20-15)13-17(24-18)25-19-21-11-6-12-22-19/h1-13H,(H,21,22,23,24,25)
InChIKeyVVPIRFRMGCNCGU-UHFFFAOYSA-N
MW326.36 g/mol
LogP3.74
Rot. Bonds4

About 2-phenyl-6-pyridin-2-yl-N-pyrimidin-2-ylpyrimidin-4-amine

2-phenyl-6-pyridin-2-yl-N-pyrimidin-2-ylpyrimidin-4-amine (PubChem CID 3411544) has the molecular formula C19H14N6 and a molecular weight of 326.36 g/mol. Its IUPAC name is 2-phenyl-6-pyridin-2-yl-N-pyrimidin-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-phenyl-6-pyridin-2-yl-N-pyrimidin-2-ylpyrimidin-4-amine
PubChem CID3411544
Molecular FormulaC19H14N6
Molecular Weight326.36 g/mol
Exact Mass326.13
IUPAC Name2-phenyl-6-pyridin-2-yl-N-pyrimidin-2-ylpyrimidin-4-amine
SMILESc1ccc(-c2nc(Nc3ncccn3)cc(-c3ccccn3)n2)cc1
InChIInChI=1S/C19H14N6/c1-2-7-14(8-3-1)18-23-16(15-9-4-5-10-20-15)13-17(24-18)25-19-21-11-6-12-22-19/h1-13H,(H,21,22,23,24,25)
InChIKeyVVPIRFRMGCNCGU-UHFFFAOYSA-N
XLogP3.74
TPSA76.48 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-6-pyridin-2-yl-N-pyrimidin-2-ylpyrimidin-4-amine?
The IUPAC name of 2-phenyl-6-pyridin-2-yl-N-pyrimidin-2-ylpyrimidin-4-amine (CID 3411544) is 2-phenyl-6-pyridin-2-yl-N-pyrimidin-2-ylpyrimidin-4-amine.
What is the SMILES notation for 2-phenyl-6-pyridin-2-yl-N-pyrimidin-2-ylpyrimidin-4-amine?
The canonical SMILES for 2-phenyl-6-pyridin-2-yl-N-pyrimidin-2-ylpyrimidin-4-amine is c1ccc(-c2nc(Nc3ncccn3)cc(-c3ccccn3)n2)cc1.
What is the InChIKey of 2-phenyl-6-pyridin-2-yl-N-pyrimidin-2-ylpyrimidin-4-amine?
The InChIKey is VVPIRFRMGCNCGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N6/c1-2-7-14(8-3-1)18-23-16(15-9-4-5-10-20-15)13-17(24-18)25-19-21-11-6-12-22-19/h1-13H,(H,21,22,23,24,25).
What are the key properties of 2-phenyl-6-pyridin-2-yl-N-pyrimidin-2-ylpyrimidin-4-amine?
2-phenyl-6-pyridin-2-yl-N-pyrimidin-2-ylpyrimidin-4-amine has a molecular weight of 326.36 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-6-pyridin-2-yl-N-pyrimidin-2-ylpyrimidin-4-amine is sourced from PubChem (CID 3411544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).