2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one

C149H96N8O26 — CID 160847369

IUPAC2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one
SMILESCOc1ccc(-c2coc3ccc4ccccc4c3c2=O)nc1.COc1ccnc(-c2coc3ccc4ccccc4c3c2=O)c1.COc1cnc(-c2coc3ccc4ccccc4c3c2=O)cc1OC.O=c1c(-c2cc3c(cn2)OCO3)coc2ccc3ccccc3c12.O=c1c(-c2ccc(O)cn2)coc2ccc3ccccc3c12.O=c1c(-c2ccccn2)coc2ccc3ccccc3c12.O=c1cc(-c2coc3ccc4ccccc4c3c2=O)[nH]cc1O.O=c1cc[nH]c(-c2coc3ccc4ccccc4c3c2=O)c1
InChIInChI=1S/C20H15NO4.C19H11NO4.2C19H13NO3.C18H11NO4.2C18H11NO3.C18H11NO2/c1-23-17-9-15(21-10-18(17)24-2)14-11-25-16-8-7-12-5-3-4-6-13(12)19(16)20(14)22;21-19-13(14-7-16-17(8-20-14)24-10-23-16)9-22-15-6-5-11-3-1-2-4-12(11)18(15)19;1-22-13-7-8-16(20-10-13)15-11-23-17-9-6-12-4-2-3-5-14(12)18(17)19(15)21;1-22-13-8-9-20-16(10-13)15-11-23-17-7-6-12-4-2-3-5-14(12)18(17)19(15)21;20-14-7-13(19-8-15(14)21)12-9-23-16-6-5-10-3-1-2-4-11(10)17(16)18(12)22;20-12-6-7-15(19-9-12)14-10-22-16-8-5-11-3-1-2-4-13(11)17(16)18(14)21;20-12-7-8-19-15(9-12)14-10-22-16-6-5-11-3-1-2-4-13(11)17(16)18(14)21;20-18-14(15-7-3-4-10-19-15)11-21-16-9-8-12-5-1-2-6-13(12)17(16)18/h3-11H,1-2H3;1-9H,10H2;2*2-11H,1H3;1-9,21H,(H,19,20);1-10,20H;1-10H,(H,19,20);1-11H
InChIKeySIUVTHQSOFNRER-UHFFFAOYSA-N
MW2414.44 g/mol
LogP29.83
Rot. Bonds12

About 2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one

2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one (PubChem CID 160847369) has the molecular formula C149H96N8O26 and a molecular weight of 2414.44 g/mol. Its IUPAC name is 2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one.

Molecular Properties

Compound Name2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one
PubChem CID160847369
Molecular FormulaC149H96N8O26
Molecular Weight2414.44 g/mol
Exact Mass2412.64
IUPAC Name2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one
SMILESCOc1ccc(-c2coc3ccc4ccccc4c3c2=O)nc1.COc1ccnc(-c2coc3ccc4ccccc4c3c2=O)c1.COc1cnc(-c2coc3ccc4ccccc4c3c2=O)cc1OC.O=c1c(-c2cc3c(cn2)OCO3)coc2ccc3ccccc3c12.O=c1c(-c2ccc(O)cn2)coc2ccc3ccccc3c12.O=c1c(-c2ccccn2)coc2ccc3ccccc3c12.O=c1cc(-c2coc3ccc4ccccc4c3c2=O)[nH]cc1O.O=c1cc[nH]c(-c2coc3ccc4ccccc4c3c2=O)c1
InChIInChI=1S/C20H15NO4.C19H11NO4.2C19H13NO3.C18H11NO4.2C18H11NO3.C18H11NO2/c1-23-17-9-15(21-10-18(17)24-2)14-11-25-16-8-7-12-5-3-4-6-13(12)19(16)20(14)22;21-19-13(14-7-16-17(8-20-14)24-10-23-16)9-22-15-6-5-11-3-1-2-4-12(11)18(15)19;1-22-13-7-8-16(20-10-13)15-11-23-17-9-6-12-4-2-3-5-14(12)18(17)19(15)21;1-22-13-8-9-20-16(10-13)15-11-23-17-7-6-12-4-2-3-5-14(12)18(17)19(15)21;20-14-7-13(19-8-15(14)21)12-9-23-16-6-5-10-3-1-2-4-11(10)17(16)18(12)22;20-12-6-7-15(19-9-12)14-10-22-16-8-5-11-3-1-2-4-13(11)17(16)18(14)21;20-12-7-8-19-15(9-12)14-10-22-16-6-5-11-3-1-2-4-13(11)17(16)18(14)21;20-18-14(15-7-3-4-10-19-15)11-21-16-9-8-12-5-1-2-6-13(12)17(16)18/h3-11H,1-2H3;1-9H,10H2;2*2-11H,1H3;1-9,21H,(H,19,20);1-10,20H;1-10H,(H,19,20);1-11H
InChIKeySIUVTHQSOFNRER-UHFFFAOYSA-N
XLogP29.83
TPSA480.58 Ų
H-Bond Donors4
H-Bond Acceptors32
Rotatable Bonds12
Heavy Atoms183
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002414.44
LogP ≤ 529.83
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one?
The IUPAC name of 2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one (CID 160847369) is 2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one.
What is the SMILES notation for 2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one?
The canonical SMILES for 2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one is COc1ccc(-c2coc3ccc4ccccc4c3c2=O)nc1.COc1ccnc(-c2coc3ccc4ccccc4c3c2=O)c1.COc1cnc(-c2coc3ccc4ccccc4c3c2=O)cc1OC.O=c1c(-c2cc3c(cn2)OCO3)coc2ccc3ccccc3c12.O=c1c(-c2ccc(O)cn2)coc2ccc3ccccc3c12.O=c1c(-c2ccccn2)coc2ccc3ccccc3c12.O=c1cc(-c2coc3ccc4ccccc4c3c2=O)[nH]cc1O.O=c1cc[nH]c(-c2coc3ccc4ccccc4c3c2=O)c1.
What is the InChIKey of 2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one?
The InChIKey is SIUVTHQSOFNRER-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15NO4.C19H11NO4.2C19H13NO3.C18H11NO4.2C18H11NO3.C18H11NO2/c1-23-17-9-15(21-10-18(17)24-2)14-11-25-16-8-7-12-5-3-4-6-13(12)19(16)20(14)22;21-19-13(14-7-16-17(8-20-14)24-10-23-16)9-22-15-6-5-11-3-1-2-4-12(11)18(15)19;1-22-13-7-8-16(20-10-13)15-11-23-17-9-6-12-4-2-3-5-14(12)18(17)19(15)21;1-22-13-8-9-20-16(10-13)15-11-23-17-7-6-12-4-2-3-5-14(12)18(17)19(15)21;20-14-7-13(19-8-15(14)21)12-9-23-16-6-5-10-3-1-2-4-11(10)17(16)18(12)22;20-12-6-7-15(19-9-12)14-10-22-16-8-5-11-3-1-2-4-13(11)17(16)18(14)21;20-12-7-8-19-15(9-12)14-10-22-16-6-5-11-3-1-2-4-13(11)17(16)18(14)21;20-18-14(15-7-3-4-10-19-15)11-21-16-9-8-12-5-1-2-6-13(12)17(16)18/h3-11H,1-2H3;1-9H,10H2;2*2-11H,1H3;1-9,21H,(H,19,20);1-10,20H;1-10H,(H,19,20);1-11H.
What are the key properties of 2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one?
2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one has a molecular weight of 2414.44 g/mol, XLogP of 29.83, 12 rotatable bonds, 4 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dimethoxy-2-pyridinyl)benzo[f]chromen-1-one;2-([1,3]dioxolo[4,5-c]pyridin-6-yl)benzo[f]chromen-1-one;5-hydroxy-2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-(5-hydroxy-2-pyridinyl)benzo[f]chromen-1-one;2-(4-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(5-methoxy-2-pyridinyl)benzo[f]chromen-1-one;2-(1-oxobenzo[f]chromen-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylbenzo[f]chromen-1-one is sourced from PubChem (CID 160847369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).