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

C110H70N6O18 — CID 158303013

IUPAC5-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.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/2C19H13NO3.C18H11NO4.2C18H11NO3.C18H11NO2/c1-22-13-7-8-16(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/h2*2-11H,1H3;1-9,21H,(H,19,20);1-10,20H;1-10H,(H,19,20);1-11H
InChIKeyGMSOTPJKDROCKC-UHFFFAOYSA-N
MW1763.79 g/mol
LogP22.06
Rot. Bonds8

About 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

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 158303013) has the molecular formula C110H70N6O18 and a molecular weight of 1763.79 g/mol. Its IUPAC name is 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 Name5-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 CID158303013
Molecular FormulaC110H70N6O18
Molecular Weight1763.79 g/mol
Exact Mass1762.47
IUPAC Name5-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.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/2C19H13NO3.C18H11NO4.2C18H11NO3.C18H11NO2/c1-22-13-7-8-16(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/h2*2-11H,1H3;1-9,21H,(H,19,20);1-10,20H;1-10H,(H,19,20);1-11H
InChIKeyGMSOTPJKDROCKC-UHFFFAOYSA-N
XLogP22.06
TPSA357.46 Ų
H-Bond Donors4
H-Bond Acceptors22
Rotatable Bonds8
Heavy Atoms134
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001763.79
LogP ≤ 522.06
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

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

Analyze 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 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 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 158303013) is 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 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 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.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 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 GMSOTPJKDROCKC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H13NO3.C18H11NO4.2C18H11NO3.C18H11NO2/c1-22-13-7-8-16(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/h2*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 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?
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 1763.79 g/mol, XLogP of 22.06, 8 rotatable bonds, 4 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 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 158303013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).