1-benzyl-5-[(5-methoxy-2-phenylphenyl)methyl]pyridin-2-one

C26H23NO2 — CID 25156915

IUPAC1-benzyl-5-[(5-methoxy-2-phenylphenyl)methyl]pyridin-2-one
SMILESCOc1ccc(-c2ccccc2)c(Cc2ccc(=O)n(Cc3ccccc3)c2)c1
InChIInChI=1S/C26H23NO2/c1-29-24-13-14-25(22-10-6-3-7-11-22)23(17-24)16-21-12-15-26(28)27(19-21)18-20-8-4-2-5-9-20/h2-15,17,19H,16,18H2,1H3
InChIKeyHCYKJGYHENOPPU-UHFFFAOYSA-N
MW381.48 g/mol
LogP5.16
Rot. Bonds6

About 1-benzyl-5-[(5-methoxy-2-phenylphenyl)methyl]pyridin-2-one

1-benzyl-5-[(5-methoxy-2-phenylphenyl)methyl]pyridin-2-one (PubChem CID 25156915) has the molecular formula C26H23NO2 and a molecular weight of 381.48 g/mol. Its IUPAC name is 1-benzyl-5-[(5-methoxy-2-phenylphenyl)methyl]pyridin-2-one.

Molecular Properties

Compound Name1-benzyl-5-[(5-methoxy-2-phenylphenyl)methyl]pyridin-2-one
PubChem CID25156915
Molecular FormulaC26H23NO2
Molecular Weight381.48 g/mol
Exact Mass381.17
IUPAC Name1-benzyl-5-[(5-methoxy-2-phenylphenyl)methyl]pyridin-2-one
SMILESCOc1ccc(-c2ccccc2)c(Cc2ccc(=O)n(Cc3ccccc3)c2)c1
InChIInChI=1S/C26H23NO2/c1-29-24-13-14-25(22-10-6-3-7-11-22)23(17-24)16-21-12-15-26(28)27(19-21)18-20-8-4-2-5-9-20/h2-15,17,19H,16,18H2,1H3
InChIKeyHCYKJGYHENOPPU-UHFFFAOYSA-N
XLogP5.16
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.48
LogP ≤ 55.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzyl-5-[(4-methoxy-2-phenylphenyl)methyl]pyridin-2-one
CID 25156635
1,5-dibenzylpyridin-2-one
CID 24938871
5-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]pyridin-2-one
CID 69444298
1-benzyl-5-(hydroxymethyl)pyridin-2-one
CID 23240890
1-[[4-(hydroxymethyl)phenyl]methyl]-5-(4-methoxyphenyl)pyridin-2-one
CID 69349835
1-methoxy-3-[(2-phenylphenyl)methyl]benzene
CID 150811208
1,2-dibenzyl-4-[(4-methoxyphenyl)methyl]-1,2,4-triazolidine-3,5-dione
CID 166447403
1-[1-benzyl-4-[3-(3-methoxyphenyl)phenyl]-2-methylpyrrol-3-yl]ethanone
CID 53493548
1-[(4-chlorophenyl)methyl]-5-[2-(3-methoxyphenyl)ethenyl]pyridin-2-one
CID 69442300
1-(4-chlorophenyl)-4-methoxy-2-[(4-phenylphenoxy)methyl]benzene
CID 174433994
1-benzyl-5-(4-methoxyphenyl)-4-methyl-2-oxopyridine-3-carbonitrile
CID 70482189
[4-(5-methoxy-2-phenylphenyl)phenyl]methanethiol
CID 91537786

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-5-[(5-methoxy-2-phenylphenyl)methyl]pyridin-2-one?
The IUPAC name of 1-benzyl-5-[(5-methoxy-2-phenylphenyl)methyl]pyridin-2-one (CID 25156915) is 1-benzyl-5-[(5-methoxy-2-phenylphenyl)methyl]pyridin-2-one.
What is the SMILES notation for 1-benzyl-5-[(5-methoxy-2-phenylphenyl)methyl]pyridin-2-one?
The canonical SMILES for 1-benzyl-5-[(5-methoxy-2-phenylphenyl)methyl]pyridin-2-one is COc1ccc(-c2ccccc2)c(Cc2ccc(=O)n(Cc3ccccc3)c2)c1.
What is the InChIKey of 1-benzyl-5-[(5-methoxy-2-phenylphenyl)methyl]pyridin-2-one?
The InChIKey is HCYKJGYHENOPPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23NO2/c1-29-24-13-14-25(22-10-6-3-7-11-22)23(17-24)16-21-12-15-26(28)27(19-21)18-20-8-4-2-5-9-20/h2-15,17,19H,16,18H2,1H3.
What are the key properties of 1-benzyl-5-[(5-methoxy-2-phenylphenyl)methyl]pyridin-2-one?
1-benzyl-5-[(5-methoxy-2-phenylphenyl)methyl]pyridin-2-one has a molecular weight of 381.48 g/mol, XLogP of 5.16, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-5-[(5-methoxy-2-phenylphenyl)methyl]pyridin-2-one is sourced from PubChem (CID 25156915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).