2-anilino-6,8-diphenyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one

C25H20N4O — CID 10318351

IUPAC2-anilino-6,8-diphenyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one
SMILESO=C1C(c2ccccc2)Cc2cnc(Nc3ccccc3)nc2N1c1ccccc1
InChIInChI=1S/C25H20N4O/c30-24-22(18-10-4-1-5-11-18)16-19-17-26-25(27-20-12-6-2-7-13-20)28-23(19)29(24)21-14-8-3-9-15-21/h1-15,17,22H,16H2,(H,26,27,28)
InChIKeyLDBUGKOPMCHTDP-UHFFFAOYSA-N
MW392.46 g/mol
LogP5.22
Rot. Bonds4

About 2-anilino-6,8-diphenyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one

2-anilino-6,8-diphenyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one (PubChem CID 10318351) has the molecular formula C25H20N4O and a molecular weight of 392.46 g/mol. Its IUPAC name is 2-anilino-6,8-diphenyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name2-anilino-6,8-diphenyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one
PubChem CID10318351
Molecular FormulaC25H20N4O
Molecular Weight392.46 g/mol
Exact Mass392.16
IUPAC Name2-anilino-6,8-diphenyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one
SMILESO=C1C(c2ccccc2)Cc2cnc(Nc3ccccc3)nc2N1c1ccccc1
InChIInChI=1S/C25H20N4O/c30-24-22(18-10-4-1-5-11-18)16-19-17-26-25(27-20-12-6-2-7-13-20)28-23(19)29(24)21-14-8-3-9-15-21/h1-15,17,22H,16H2,(H,26,27,28)
InChIKeyLDBUGKOPMCHTDP-UHFFFAOYSA-N
XLogP5.22
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.46
LogP ≤ 55.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-anilino-6,8-diphenyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 2-anilino-6,8-diphenyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one (CID 10318351) is 2-anilino-6,8-diphenyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 2-anilino-6,8-diphenyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 2-anilino-6,8-diphenyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one is O=C1C(c2ccccc2)Cc2cnc(Nc3ccccc3)nc2N1c1ccccc1.
What is the InChIKey of 2-anilino-6,8-diphenyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one?
The InChIKey is LDBUGKOPMCHTDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N4O/c30-24-22(18-10-4-1-5-11-18)16-19-17-26-25(27-20-12-6-2-7-13-20)28-23(19)29(24)21-14-8-3-9-15-21/h1-15,17,22H,16H2,(H,26,27,28).
What are the key properties of 2-anilino-6,8-diphenyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one?
2-anilino-6,8-diphenyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one has a molecular weight of 392.46 g/mol, XLogP of 5.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-6,8-diphenyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 10318351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).