1-(4-ethoxyphenyl)-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one

C21H19NO5 — CID 44817924

IUPAC1-(4-ethoxyphenyl)-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one
SMILESCCOc1ccc(-n2cc(C(=O)c3ccc(OC)cc3O)ccc2=O)cc1
InChIInChI=1S/C21H19NO5/c1-3-27-16-7-5-15(6-8-16)22-13-14(4-11-20(22)24)21(25)18-10-9-17(26-2)12-19(18)23/h4-13,23H,3H2,1-2H3
InChIKeyUFPXXSPJUBYJGF-UHFFFAOYSA-N
MW365.39 g/mol
LogP3.18
Rot. Bonds6

About 1-(4-ethoxyphenyl)-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one

1-(4-ethoxyphenyl)-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one (PubChem CID 44817924) has the molecular formula C21H19NO5 and a molecular weight of 365.39 g/mol. Its IUPAC name is 1-(4-ethoxyphenyl)-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one.

Molecular Properties

Compound Name1-(4-ethoxyphenyl)-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one
PubChem CID44817924
Molecular FormulaC21H19NO5
Molecular Weight365.39 g/mol
Exact Mass365.13
IUPAC Name1-(4-ethoxyphenyl)-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one
SMILESCCOc1ccc(-n2cc(C(=O)c3ccc(OC)cc3O)ccc2=O)cc1
InChIInChI=1S/C21H19NO5/c1-3-27-16-7-5-15(6-8-16)22-13-14(4-11-20(22)24)21(25)18-10-9-17(26-2)12-19(18)23/h4-13,23H,3H2,1-2H3
InChIKeyUFPXXSPJUBYJGF-UHFFFAOYSA-N
XLogP3.18
TPSA77.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(3-Morpholinopropoxy)-N-(3-(trifluoromethyl)phenyl)-2-hydroxybenzamide (11a)
CID 91937891
4-(3-(Piperidin-1-yl)propoxy)-N-(3-(trifluoromethyl)phenyl)-2-hydroxybenzamide (11b)
CID 91937897
4-(3-Morpholinopropoxy)-N-(m-tolyl)-2-hydroxybenzamide (10a)
CID 91937890
1-(4-Ethoxyphenyl)-4-[4-(4-hydroxyphenyl)piperazin-1-yl]butane-1,4-dione
CID 2407509
Chalcone, 4-(dimethylamino)-2',4'-dimethoxy-
CID 5743234
(2,4-Dimethoxyphenyl)[4-(morpholin-4-yl)phenyl]methanone
CID 658490
N-(4-ethoxyphenyl)-2,6-dimethoxybenzamide
CID 668882
2-[4-(Dimethylamino)benzylidene]-6-hydroxy-1-benzofuran-3(2h)-one
CID 1523064
(Z)-2-(4-(dimethylamino)benzylidene)-6-hydroxybenzofuran-3(2H)-one
CID 1523065
5-(2-Hydroxy-4-methoxybenzoyl)-1-(3-methylphenyl)pyridin-2-one
CID 44818098
5-(2-Hydroxy-4-methoxybenzoyl)-1-(o-tolyl)pyridin-2(1h)-one
CID 44818099
1-Cyclohexyl-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one
CID 44818273

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyphenyl)-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one?
The IUPAC name of 1-(4-ethoxyphenyl)-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one (CID 44817924) is 1-(4-ethoxyphenyl)-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one.
What is the SMILES notation for 1-(4-ethoxyphenyl)-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one?
The canonical SMILES for 1-(4-ethoxyphenyl)-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one is CCOc1ccc(-n2cc(C(=O)c3ccc(OC)cc3O)ccc2=O)cc1.
What is the InChIKey of 1-(4-ethoxyphenyl)-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one?
The InChIKey is UFPXXSPJUBYJGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO5/c1-3-27-16-7-5-15(6-8-16)22-13-14(4-11-20(22)24)21(25)18-10-9-17(26-2)12-19(18)23/h4-13,23H,3H2,1-2H3.
What are the key properties of 1-(4-ethoxyphenyl)-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one?
1-(4-ethoxyphenyl)-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one has a molecular weight of 365.39 g/mol, XLogP of 3.18, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxyphenyl)-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2-one is sourced from PubChem (CID 44817924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).