10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione

C78H64N16O16 — CID 162258757

IUPAC10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione
SMILESO=C1CCN2C(=O)c3cccc(-n4c(=O)[nH]c5cnccc5c4=O)c3C2C1.O=C1c2cccc(-n3c(=O)[nH]c4cnccc4c3=O)c2C2CC(O)CCN12.O=C1c2cccc(-n3c(=O)[nH]c4cnccc4c3=O)c2C2CC3(CCN12)OCCO3.O=C1c2cccc(-n3c(=O)[nH]c4cnccc4c3=O)c2C2CCCCN12
InChIInChI=1S/C21H18N4O5.C19H16N4O4.C19H14N4O4.C19H16N4O3/c26-18-13-2-1-3-15(25-19(27)12-4-6-22-11-14(12)23-20(25)28)17(13)16-10-21(5-7-24(16)18)29-8-9-30-21;2*24-10-5-7-22-15(8-10)16-12(17(22)25)2-1-3-14(16)23-18(26)11-4-6-20-9-13(11)21-19(23)27;24-17-12-4-3-6-15(16(12)14-5-1-2-9-22(14)17)23-18(25)11-7-8-20-10-13(11)21-19(23)26/h1-4,6,11,16H,5,7-10H2,(H,23,28);1-4,6,9-10,15,24H,5,7-8H2,(H,21,27);1-4,6,9,15H,5,7-8H2,(H,21,27);3-4,6-8,10,14H,1-2,5,9H2,(H,21,26)
InChIKeyZYYGLFHJJSAJOM-UHFFFAOYSA-N
MW1481.47 g/mol
LogP4.52
Rot. Bonds4

About 10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione

10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione (PubChem CID 162258757) has the molecular formula C78H64N16O16 and a molecular weight of 1481.47 g/mol. Its IUPAC name is 10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione
PubChem CID162258757
Molecular FormulaC78H64N16O16
Molecular Weight1481.47 g/mol
Exact Mass1480.47
IUPAC Name10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione
SMILESO=C1CCN2C(=O)c3cccc(-n4c(=O)[nH]c5cnccc5c4=O)c3C2C1.O=C1c2cccc(-n3c(=O)[nH]c4cnccc4c3=O)c2C2CC(O)CCN12.O=C1c2cccc(-n3c(=O)[nH]c4cnccc4c3=O)c2C2CC3(CCN12)OCCO3.O=C1c2cccc(-n3c(=O)[nH]c4cnccc4c3=O)c2C2CCCCN12
InChIInChI=1S/C21H18N4O5.C19H16N4O4.C19H14N4O4.C19H16N4O3/c26-18-13-2-1-3-15(25-19(27)12-4-6-22-11-14(12)23-20(25)28)17(13)16-10-21(5-7-24(16)18)29-8-9-30-21;2*24-10-5-7-22-15(8-10)16-12(17(22)25)2-1-3-14(16)23-18(26)11-4-6-20-9-13(11)21-19(23)27;24-17-12-4-3-6-15(16(12)14-5-1-2-9-22(14)17)23-18(25)11-7-8-20-10-13(11)21-19(23)26/h1-4,6,11,16H,5,7-10H2,(H,23,28);1-4,6,9-10,15,24H,5,7-8H2,(H,21,27);1-4,6,9,15H,5,7-8H2,(H,21,27);3-4,6-8,10,14H,1-2,5,9H2,(H,21,26)
InChIKeyZYYGLFHJJSAJOM-UHFFFAOYSA-N
XLogP4.52
TPSA408.00 Ų
H-Bond Donors5
H-Bond Acceptors24
Rotatable Bonds4
Heavy Atoms110
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001481.47
LogP ≤ 54.52
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1024

Analyze 10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione with MolForge

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Related Compounds

3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione
CID 67284480
acetyl acetate;ethyl 2-[(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)carbamoylamino]pyridine-3-carboxylate;furo[3,4-c]pyridine-1,3-dione;methanol;2-methoxycarbonylpyridine-3-carboxylic acid;4-methoxycarbonylpyridine-3-carboxylic acid;methyl 2-aminopyridine-3-carboxylate;methyl 3-isocyanatopyridine-4-carboxylate;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[2,3-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,2-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;pyridine-3,4-dicarbaldehyde
CID 157095013

Frequently Asked Questions

What is the IUPAC name of 10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione?
The IUPAC name of 10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione (CID 162258757) is 10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione.
What is the SMILES notation for 10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione?
The canonical SMILES for 10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione is O=C1CCN2C(=O)c3cccc(-n4c(=O)[nH]c5cnccc5c4=O)c3C2C1.O=C1c2cccc(-n3c(=O)[nH]c4cnccc4c3=O)c2C2CC(O)CCN12.O=C1c2cccc(-n3c(=O)[nH]c4cnccc4c3=O)c2C2CC3(CCN12)OCCO3.O=C1c2cccc(-n3c(=O)[nH]c4cnccc4c3=O)c2C2CCCCN12.
What is the InChIKey of 10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione?
The InChIKey is ZYYGLFHJJSAJOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O5.C19H16N4O4.C19H14N4O4.C19H16N4O3/c26-18-13-2-1-3-15(25-19(27)12-4-6-22-11-14(12)23-20(25)28)17(13)16-10-21(5-7-24(16)18)29-8-9-30-21;2*24-10-5-7-22-15(8-10)16-12(17(22)25)2-1-3-14(16)23-18(26)11-4-6-20-9-13(11)21-19(23)27;24-17-12-4-3-6-15(16(12)14-5-1-2-9-22(14)17)23-18(25)11-7-8-20-10-13(11)21-19(23)26/h1-4,6,11,16H,5,7-10H2,(H,23,28);1-4,6,9-10,15,24H,5,7-8H2,(H,21,27);1-4,6,9,15H,5,7-8H2,(H,21,27);3-4,6-8,10,14H,1-2,5,9H2,(H,21,26).
What are the key properties of 10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione?
10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione has a molecular weight of 1481.47 g/mol, XLogP of 4.52, 4 rotatable bonds, 5 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl)-1,3,4,10b-tetrahydropyrido[1,2-b]isoindole-2,6-dione;3-(2-hydroxy-6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxo-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione;3-(6-oxospiro[1,3,4,10b-tetrahydropyrido[2,1-a]isoindole-2,2'-1,3-dioxolane]-10-yl)-1H-pyrido[3,4-d]pyrimidine-2,4-dione is sourced from PubChem (CID 162258757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).