2-benzyl-4-phenyl-[1]benzofuro[2,3-c]pyridin-1-one

C24H17NO2 — CID 15418266

IUPAC2-benzyl-4-phenyl-[1]benzofuro[2,3-c]pyridin-1-one
SMILESO=c1c2oc3ccccc3c2c(-c2ccccc2)cn1Cc1ccccc1
InChIInChI=1S/C24H17NO2/c26-24-23-22(19-13-7-8-14-21(19)27-23)20(18-11-5-2-6-12-18)16-25(24)15-17-9-3-1-4-10-17/h1-14,16H,15H2
InChIKeyYADGSBLVODHLBC-UHFFFAOYSA-N
MW351.41 g/mol
LogP5.46
Rot. Bonds3

About 2-benzyl-4-phenyl-[1]benzofuro[2,3-c]pyridin-1-one

2-benzyl-4-phenyl-[1]benzofuro[2,3-c]pyridin-1-one (PubChem CID 15418266) has the molecular formula C24H17NO2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 2-benzyl-4-phenyl-[1]benzofuro[2,3-c]pyridin-1-one.

Molecular Properties

Compound Name2-benzyl-4-phenyl-[1]benzofuro[2,3-c]pyridin-1-one
PubChem CID15418266
Molecular FormulaC24H17NO2
Molecular Weight351.41 g/mol
Exact Mass351.13
IUPAC Name2-benzyl-4-phenyl-[1]benzofuro[2,3-c]pyridin-1-one
SMILESO=c1c2oc3ccccc3c2c(-c2ccccc2)cn1Cc1ccccc1
InChIInChI=1S/C24H17NO2/c26-24-23-22(19-13-7-8-14-21(19)27-23)20(18-11-5-2-6-12-18)16-25(24)15-17-9-3-1-4-10-17/h1-14,16H,15H2
InChIKeyYADGSBLVODHLBC-UHFFFAOYSA-N
XLogP5.46
TPSA35.14 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.41
LogP ≤ 55.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-benzyl-4-phenyl-[1]benzofuro[2,3-c]pyridin-1-one?
The IUPAC name of 2-benzyl-4-phenyl-[1]benzofuro[2,3-c]pyridin-1-one (CID 15418266) is 2-benzyl-4-phenyl-[1]benzofuro[2,3-c]pyridin-1-one.
What is the SMILES notation for 2-benzyl-4-phenyl-[1]benzofuro[2,3-c]pyridin-1-one?
The canonical SMILES for 2-benzyl-4-phenyl-[1]benzofuro[2,3-c]pyridin-1-one is O=c1c2oc3ccccc3c2c(-c2ccccc2)cn1Cc1ccccc1.
What is the InChIKey of 2-benzyl-4-phenyl-[1]benzofuro[2,3-c]pyridin-1-one?
The InChIKey is YADGSBLVODHLBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17NO2/c26-24-23-22(19-13-7-8-14-21(19)27-23)20(18-11-5-2-6-12-18)16-25(24)15-17-9-3-1-4-10-17/h1-14,16H,15H2.
What are the key properties of 2-benzyl-4-phenyl-[1]benzofuro[2,3-c]pyridin-1-one?
2-benzyl-4-phenyl-[1]benzofuro[2,3-c]pyridin-1-one has a molecular weight of 351.41 g/mol, XLogP of 5.46, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-4-phenyl-[1]benzofuro[2,3-c]pyridin-1-one is sourced from PubChem (CID 15418266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).