6-(4-fluorophenyl)-4-hydroxy-5-methyl-3-phenylmethoxy-1H-pyridin-2-one

C19H16FNO3 — CID 67708906

IUPAC6-(4-fluorophenyl)-4-hydroxy-5-methyl-3-phenylmethoxy-1H-pyridin-2-one
SMILESCc1c(-c2ccc(F)cc2)[nH]c(=O)c(OCc2ccccc2)c1O
InChIInChI=1S/C19H16FNO3/c1-12-16(14-7-9-15(20)10-8-14)21-19(23)18(17(12)22)24-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H2,21,22,23)
InChIKeyRUBQVSQTICMVDD-UHFFFAOYSA-N
MW325.34 g/mol
LogP3.77
Rot. Bonds4

About 6-(4-fluorophenyl)-4-hydroxy-5-methyl-3-phenylmethoxy-1H-pyridin-2-one

6-(4-fluorophenyl)-4-hydroxy-5-methyl-3-phenylmethoxy-1H-pyridin-2-one (PubChem CID 67708906) has the molecular formula C19H16FNO3 and a molecular weight of 325.34 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-4-hydroxy-5-methyl-3-phenylmethoxy-1H-pyridin-2-one.

Molecular Properties

Compound Name6-(4-fluorophenyl)-4-hydroxy-5-methyl-3-phenylmethoxy-1H-pyridin-2-one
PubChem CID67708906
Molecular FormulaC19H16FNO3
Molecular Weight325.34 g/mol
Exact Mass325.11
IUPAC Name6-(4-fluorophenyl)-4-hydroxy-5-methyl-3-phenylmethoxy-1H-pyridin-2-one
SMILESCc1c(-c2ccc(F)cc2)[nH]c(=O)c(OCc2ccccc2)c1O
InChIInChI=1S/C19H16FNO3/c1-12-16(14-7-9-15(20)10-8-14)21-19(23)18(17(12)22)24-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H2,21,22,23)
InChIKeyRUBQVSQTICMVDD-UHFFFAOYSA-N
XLogP3.77
TPSA62.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.34
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-hydroxy-2-methyl-4,5-bis(phenylmethoxy)benzoic acid
CID 175815077
2-amino-4-(3,5-difluoro-4-phenylmethoxyphenyl)-6-oxo-1H-pyridine-3,5-dicarboxylic acid
CID 169406273
5-(4-fluorophenyl)-2-phenylmethoxybenzoic acid
CID 154202317
2-[(4-fluorophenyl)methoxy]phenol
CID 43143460
1-fluoro-4-[2-[(4-methylphenyl)methoxy]phenyl]benzene
CID 123297454
2-(3-fluoro-2-methyl-4-phenylmethoxyphenyl)acetic acid
CID 166161146
2,3,5,6-tetramethyl-4-phenylmethoxybenzaldehyde
CID 71408995
4-[2,4,5-trimethyl-3,6-bis(phenylmethoxy)phenyl]butan-2-one
CID 54428047
5-tert-butyl-1-(4-fluorophenyl)-2-phenylmethoxy-3-propan-2-ylbenzene
CID 14515043
4-hydroxy-5-methyl-6-phenylmethoxy-3H-2-benzofuran-1-one
CID 163961951
2-phenylmethoxybenzene-1,3-diol
CID 15652625
2,4,5-trimethyl-3,6-bis(phenylmethoxy)benzaldehyde
CID 86653777

Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-4-hydroxy-5-methyl-3-phenylmethoxy-1H-pyridin-2-one?
The IUPAC name of 6-(4-fluorophenyl)-4-hydroxy-5-methyl-3-phenylmethoxy-1H-pyridin-2-one (CID 67708906) is 6-(4-fluorophenyl)-4-hydroxy-5-methyl-3-phenylmethoxy-1H-pyridin-2-one.
What is the SMILES notation for 6-(4-fluorophenyl)-4-hydroxy-5-methyl-3-phenylmethoxy-1H-pyridin-2-one?
The canonical SMILES for 6-(4-fluorophenyl)-4-hydroxy-5-methyl-3-phenylmethoxy-1H-pyridin-2-one is Cc1c(-c2ccc(F)cc2)[nH]c(=O)c(OCc2ccccc2)c1O.
What is the InChIKey of 6-(4-fluorophenyl)-4-hydroxy-5-methyl-3-phenylmethoxy-1H-pyridin-2-one?
The InChIKey is RUBQVSQTICMVDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FNO3/c1-12-16(14-7-9-15(20)10-8-14)21-19(23)18(17(12)22)24-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H2,21,22,23).
What are the key properties of 6-(4-fluorophenyl)-4-hydroxy-5-methyl-3-phenylmethoxy-1H-pyridin-2-one?
6-(4-fluorophenyl)-4-hydroxy-5-methyl-3-phenylmethoxy-1H-pyridin-2-one has a molecular weight of 325.34 g/mol, XLogP of 3.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-4-hydroxy-5-methyl-3-phenylmethoxy-1H-pyridin-2-one is sourced from PubChem (CID 67708906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).