3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one

C19H17NO2 — CID 169490402

IUPAC3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one
SMILESCc1cc(-c2ccc(OCc3ccccc3)cc2)c[nH]c1=O
InChIInChI=1S/C19H17NO2/c1-14-11-17(12-20-19(14)21)16-7-9-18(10-8-16)22-13-15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H,20,21)
InChIKeyVOFOUEJGNNCGSP-UHFFFAOYSA-N
MW291.35 g/mol
LogP3.93
Rot. Bonds4

About 3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one

3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one (PubChem CID 169490402) has the molecular formula C19H17NO2 and a molecular weight of 291.35 g/mol. Its IUPAC name is 3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one
PubChem CID169490402
Molecular FormulaC19H17NO2
Molecular Weight291.35 g/mol
Exact Mass291.13
IUPAC Name3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one
SMILESCc1cc(-c2ccc(OCc3ccccc3)cc2)c[nH]c1=O
InChIInChI=1S/C19H17NO2/c1-14-11-17(12-20-19(14)21)16-7-9-18(10-8-16)22-13-15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H,20,21)
InChIKeyVOFOUEJGNNCGSP-UHFFFAOYSA-N
XLogP3.93
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 4-(4-hydroxyphenyl)-1H-pyrrole-2-carboxylate;ethyl 4-(4-phenylmethoxyphenyl)-1H-pyrrole-2-carboxylate
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3-methyl-5-(4-phenylmethoxyphenyl)pyridine-2-carboxylic acid
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fluoromethane;1-methyl-4-phenylmethoxybenzene
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5-chloro-3-phenylmethoxy-1H-pyridin-2-one
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3-(4-phenylmethoxyphenyl)benzamide
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2-methyl-3-(4-phenylmethoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-4-one
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(4-methylphenyl)-(4-phenylmethoxyphenyl)methanone
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2,6-bis(4-methoxyphenyl)-4-(4-phenylmethoxyphenyl)pyridine
CID 132564654
(3E)-5-(3,4-dimethylphenyl)-3-[(4-phenylmethoxyphenyl)methylidene]furan-2-one
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1,3-diphenylbenzene;4-phenylmethoxyphenol
CID 70041760

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one?
The IUPAC name of 3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one (CID 169490402) is 3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one.
What is the SMILES notation for 3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one?
The canonical SMILES for 3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one is Cc1cc(-c2ccc(OCc3ccccc3)cc2)c[nH]c1=O.
What is the InChIKey of 3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one?
The InChIKey is VOFOUEJGNNCGSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO2/c1-14-11-17(12-20-19(14)21)16-7-9-18(10-8-16)22-13-15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H,20,21).
What are the key properties of 3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one?
3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one has a molecular weight of 291.35 g/mol, XLogP of 3.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(4-phenylmethoxyphenyl)-1H-pyridin-2-one is sourced from PubChem (CID 169490402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).