5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one

C26H23NO2 — CID 101375308

IUPAC5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one
SMILESO=C1C2=C(CCN1Cc1ccccc1)OC(c1ccccc1)(c1ccccc1)C2
InChIInChI=1S/C26H23NO2/c28-25-23-18-26(21-12-6-2-7-13-21,22-14-8-3-9-15-22)29-24(23)16-17-27(25)19-20-10-4-1-5-11-20/h1-15H,16-19H2
InChIKeyVIUZPGAVYNUJRH-UHFFFAOYSA-N
MW381.48 g/mol
LogP5.04
Rot. Bonds4

About 5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one

5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one (PubChem CID 101375308) has the molecular formula C26H23NO2 and a molecular weight of 381.48 g/mol. Its IUPAC name is 5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one.

Molecular Properties

Compound Name5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one
PubChem CID101375308
Molecular FormulaC26H23NO2
Molecular Weight381.48 g/mol
Exact Mass381.17
IUPAC Name5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one
SMILESO=C1C2=C(CCN1Cc1ccccc1)OC(c1ccccc1)(c1ccccc1)C2
InChIInChI=1S/C26H23NO2/c28-25-23-18-26(21-12-6-2-7-13-21,22-14-8-3-9-15-22)29-24(23)16-17-27(25)19-20-10-4-1-5-11-20/h1-15H,16-19H2
InChIKeyVIUZPGAVYNUJRH-UHFFFAOYSA-N
XLogP5.04
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.48
LogP ≤ 55.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Isoindolinone scaffold, 44
CID 16090401
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1-Benzyl-3-phenyl-4-phenylmethoxypyridin-2-one
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CID 71469499
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CID 134835233
3,6-dibenzyl-2-phenyl-2H-1,3-oxazin-4-one
CID 134843558
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CID 135012235
[(1R)-1-[(E)-3-(4-methylphenyl)prop-2-enyl]spiro[1H-2-benzofuran-3,4'-piperidine]-1'-yl]-phenylmethanone
CID 166442873

Frequently Asked Questions

What is the IUPAC name of 5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one?
The IUPAC name of 5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one (CID 101375308) is 5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one.
What is the SMILES notation for 5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one?
The canonical SMILES for 5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one is O=C1C2=C(CCN1Cc1ccccc1)OC(c1ccccc1)(c1ccccc1)C2.
What is the InChIKey of 5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one?
The InChIKey is VIUZPGAVYNUJRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23NO2/c28-25-23-18-26(21-12-6-2-7-13-21,22-14-8-3-9-15-22)29-24(23)16-17-27(25)19-20-10-4-1-5-11-20/h1-15H,16-19H2.
What are the key properties of 5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one?
5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one has a molecular weight of 381.48 g/mol, XLogP of 5.04, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one is sourced from PubChem (CID 101375308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).