3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one

C16H15NO4 — CID 174426896

IUPAC3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one
SMILESCOc1ccc(C=C2OC(O)c3c2cc(C)[nH]c3=O)cc1
InChIInChI=1S/C16H15NO4/c1-9-7-12-13(21-16(19)14(12)15(18)17-9)8-10-3-5-11(20-2)6-4-10/h3-8,16,19H,1-2H3,(H,17,18)
InChIKeyUQASJBHUPOYGIC-UHFFFAOYSA-N
MW285.30 g/mol
LogP2.21
Rot. Bonds2

About 3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one

3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one (PubChem CID 174426896) has the molecular formula C16H15NO4 and a molecular weight of 285.30 g/mol. Its IUPAC name is 3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one.

Molecular Properties

Compound Name3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one
PubChem CID174426896
Molecular FormulaC16H15NO4
Molecular Weight285.30 g/mol
Exact Mass285.10
IUPAC Name3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one
SMILESCOc1ccc(C=C2OC(O)c3c2cc(C)[nH]c3=O)cc1
InChIInChI=1S/C16H15NO4/c1-9-7-12-13(21-16(19)14(12)15(18)17-9)8-10-3-5-11(20-2)6-4-10/h3-8,16,19H,1-2H3,(H,17,18)
InChIKeyUQASJBHUPOYGIC-UHFFFAOYSA-N
XLogP2.21
TPSA71.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one with MolForge

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Related Compounds

4-(4-methoxyphenyl)-6-methyl-2-oxo-1H-pyridine-3-carboxylic acid
CID 82089759
4-(4-methoxyphenyl)-7-methyl-4,6-dihydro-3H-pyrano[3,2-c]pyridine-2,5-dione
CID 71755298
(5Z)-3,4-bis(2,5-dimethylthiophen-3-yl)-5-[(4-methoxyphenyl)methylidene]furan-2-one
CID 101460676
2-[(4-methoxyphenyl)methylidene]-1-benzofuran-3-one
CID 619835
(3Z)-6-methoxy-3-[(4-methylphenyl)methylidene]-1-(trifluoromethyl)-1H-2-benzofuran
CID 135022524
2-[(4-hydroxyphenyl)methylidene]-6-methoxy-1-benzofuran-3-one
CID 578349
3-[(Z)-3-(4-methoxyphenyl)-2-phenylprop-2-enoyl]-4,6-dimethyl-1H-pyridin-2-one
CID 6270719
(5Z)-4-(4-methoxyphenyl)-5-[(4-methoxyphenyl)methylidene]furan-2-one
CID 11587605
(3Z)-7-hydroxy-3-[(4-methoxyphenyl)methylidene]-2-methylchromen-4-one
CID 134113942
(4S)-2-amino-4-(4-methoxyphenyl)-7-methyl-5-oxo-4,6-dihydropyrano[3,2-c]pyridine-3-carbonitrile
CID 950544
(4R)-2-amino-4-(4-methoxyphenyl)-7-methyl-5-oxo-4,6-dihydropyrano[3,2-c]pyridine-3-carbonitrile
CID 950545
4-(6-methoxynaphthalen-2-yl)-6-methyl-2-oxo-1H-pyridine-3-carbonitrile
CID 168585110

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one?
The IUPAC name of 3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one (CID 174426896) is 3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one.
What is the SMILES notation for 3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one?
The canonical SMILES for 3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one is COc1ccc(C=C2OC(O)c3c2cc(C)[nH]c3=O)cc1.
What is the InChIKey of 3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one?
The InChIKey is UQASJBHUPOYGIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO4/c1-9-7-12-13(21-16(19)14(12)15(18)17-9)8-10-3-5-11(20-2)6-4-10/h3-8,16,19H,1-2H3,(H,17,18).
What are the key properties of 3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one?
3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one has a molecular weight of 285.30 g/mol, XLogP of 2.21, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-1-[(4-methoxyphenyl)methylidene]-6-methyl-3,5-dihydrofuro[3,4-c]pyridin-4-one is sourced from PubChem (CID 174426896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).