7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one

C88H85F3N20O4 — CID 161396874

IUPAC7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one
SMILESCc1cc2ccc(-c3ccc4nc(C5CCNCC5)cc(=O)n4c3)cn2c1.Cc1cn2cc(-c3cc(=O)n4cc(N5CCN(C6CC6)CC5)ccc4n3)cc(F)c2n1.Cc1cn2cc(-c3ccc4nc(C5=CCN(C)CC5)cc(=O)n4c3)cc(F)c2n1.Cc1cn2cc(-c3ccc4nc(C5CCNCC5)cc(=O)n4c3)cc(F)c2n1
InChIInChI=1S/C23H23FN6O.C22H20FN5O.C22H22N4O.C21H20FN5O/c1-15-12-29-13-16(10-19(24)23(29)25-15)20-11-22(31)30-14-18(4-5-21(30)26-20)28-8-6-27(7-9-28)17-2-3-17;1-14-11-27-12-17(9-18(23)22(27)24-14)16-3-4-20-25-19(10-21(29)28(20)13-16)15-5-7-26(2)8-6-15;1-15-10-19-4-2-17(13-25(19)12-15)18-3-5-21-24-20(11-22(27)26(21)14-18)16-6-8-23-9-7-16;1-13-10-26-11-16(8-17(22)21(26)24-13)15-2-3-19-25-18(9-20(28)27(19)12-15)14-4-6-23-7-5-14/h4-5,10-14,17H,2-3,6-9H2,1H3;3-5,9-13H,6-8H2,1-2H3;2-5,10-14,16,23H,6-9H2,1H3;2-3,8-12,14,23H,4-7H2,1H3
InChIKeyVTSGOWAIXZYTOG-UHFFFAOYSA-N
MW1543.78 g/mol
LogP12.23
Rot. Bonds9

About 7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one

7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one (PubChem CID 161396874) has the molecular formula C88H85F3N20O4 and a molecular weight of 1543.78 g/mol. Its IUPAC name is 7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one
PubChem CID161396874
Molecular FormulaC88H85F3N20O4
Molecular Weight1543.78 g/mol
Exact Mass1542.70
IUPAC Name7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one
SMILESCc1cc2ccc(-c3ccc4nc(C5CCNCC5)cc(=O)n4c3)cn2c1.Cc1cn2cc(-c3cc(=O)n4cc(N5CCN(C6CC6)CC5)ccc4n3)cc(F)c2n1.Cc1cn2cc(-c3ccc4nc(C5=CCN(C)CC5)cc(=O)n4c3)cc(F)c2n1.Cc1cn2cc(-c3ccc4nc(C5CCNCC5)cc(=O)n4c3)cc(F)c2n1
InChIInChI=1S/C23H23FN6O.C22H20FN5O.C22H22N4O.C21H20FN5O/c1-15-12-29-13-16(10-19(24)23(29)25-15)20-11-22(31)30-14-18(4-5-21(30)26-20)28-8-6-27(7-9-28)17-2-3-17;1-14-11-27-12-17(9-18(23)22(27)24-14)16-3-4-20-25-19(10-21(29)28(20)13-16)15-5-7-26(2)8-6-15;1-15-10-19-4-2-17(13-25(19)12-15)18-3-5-21-24-20(11-22(27)26(21)14-18)16-6-8-23-9-7-16;1-13-10-26-11-16(8-17(22)21(26)24-13)15-2-3-19-25-18(9-20(28)27(19)12-15)14-4-6-23-7-5-14/h4-5,10-14,17H,2-3,6-9H2,1H3;3-5,9-13H,6-8H2,1-2H3;2-5,10-14,16,23H,6-9H2,1H3;2-3,8-12,14,23H,4-7H2,1H3
InChIKeyVTSGOWAIXZYTOG-UHFFFAOYSA-N
XLogP12.23
TPSA227.57 Ų
H-Bond Donors2
H-Bond Acceptors24
Rotatable Bonds9
Heavy Atoms115
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001543.78
LogP ≤ 512.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1024

Analyze 7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one with MolForge

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Launch Full Analysis

Related Compounds

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Imidazo[1,2-a]pyridin-3-yl-[4-[[5-[4-methyl-6-[[4-(trifluoromethyl)-2-pyridinyl]amino]-2-pyridinyl]-2-pyridinyl]amino]piperidin-1-yl]methanone
CID 119098988
7-[[6-(3,3a,4,5,6,6a-hexahydro-2H-pyrrolo[2,3-c]pyrrol-1-yl)-2-pyridinyl]amino]-4-(8-fluoro-7-methylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydropyrrolo[3,4-c]pyridin-1-one
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Synthesis of (R,E)-4-(dimethylamino)-N-(1-(2-(1-(4-fluorobenzyl)-1H-indol-2-yl)-3-methylimidazo[1,2-a]pyridine-7-carbonyl)piperidin-3-yl)but-2-enamide
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US10842803, Structure TABLE 1.38
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[1-[(2-Amino-6-methyl-4-pyridinyl)methyl]-4-fluoropiperidin-4-yl]-[4-(2-pyridin-2-ylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]methanone
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Frequently Asked Questions

What is the IUPAC name of 7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one (CID 161396874) is 7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one is Cc1cc2ccc(-c3ccc4nc(C5CCNCC5)cc(=O)n4c3)cn2c1.Cc1cn2cc(-c3cc(=O)n4cc(N5CCN(C6CC6)CC5)ccc4n3)cc(F)c2n1.Cc1cn2cc(-c3ccc4nc(C5=CCN(C)CC5)cc(=O)n4c3)cc(F)c2n1.Cc1cn2cc(-c3ccc4nc(C5CCNCC5)cc(=O)n4c3)cc(F)c2n1.
What is the InChIKey of 7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The InChIKey is VTSGOWAIXZYTOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23FN6O.C22H20FN5O.C22H22N4O.C21H20FN5O/c1-15-12-29-13-16(10-19(24)23(29)25-15)20-11-22(31)30-14-18(4-5-21(30)26-20)28-8-6-27(7-9-28)17-2-3-17;1-14-11-27-12-17(9-18(23)22(27)24-14)16-3-4-20-25-19(10-21(29)28(20)13-16)15-5-7-26(2)8-6-15;1-15-10-19-4-2-17(13-25(19)12-15)18-3-5-21-24-20(11-22(27)26(21)14-18)16-6-8-23-9-7-16;1-13-10-26-11-16(8-17(22)21(26)24-13)15-2-3-19-25-18(9-20(28)27(19)12-15)14-4-6-23-7-5-14/h4-5,10-14,17H,2-3,6-9H2,1H3;3-5,9-13H,6-8H2,1-2H3;2-5,10-14,16,23H,6-9H2,1H3;2-3,8-12,14,23H,4-7H2,1H3.
What are the key properties of 7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one?
7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one has a molecular weight of 1543.78 g/mol, XLogP of 12.23, 9 rotatable bonds, 2 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-cyclopropylpiperazin-1-yl)-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrido[1,2-a]pyrimidin-4-one;7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one;7-(2-methylindolizin-6-yl)-2-piperidin-4-ylpyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 161396874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).