6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid

C223H327BrN38O32Si4 — CID 158357641

IUPAC6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid
SMILESCC(=O)c1c(C)c2cnc(Cc3ccc(N4CCN(CCN5CCC(CBr)CC5=O)CC4)cn3)nc2n(C2CCCC2)c1=O.CC(=O)c1c(C)c2cnc(Cc3ccc(N4CCN(CCN5CCC(CN6CCN(c7ccc8c(c7)CN(C7CCC(=O)NC7=O)C8=O)CC6)CC5=O)CC4)cn3)nc2n(C2CCCC2)c1=O.CC(=O)c1c(C)c2cnc(Cc3ccc(N4CCN(CCN5CCC(CO)CC5=O)CC4)cn3)nc2n(C2CCCC2)c1=O.CC(C)(C)[Si](C)(C)OCC1CCN(CC=O)C(=O)C1.CC(C)(C)[Si](C)(C)OCC1CCN(CCO)C(=O)C1.CC(C)(C)[Si](C)(C)OCC1CCN(CCOCc2ccccc2)C(=O)C1.CC(C)(C)[Si](C)(C)OCC1CCNC(=O)C1.CCC1CCN(CCN2CCN(c3ccc(Cc4ncc5c(C)c(C(C)=O)c(=O)n(C6CCCC6)c5n4)nc3)CC2)C(=O)C1.O=C1CC(C(=O)O)CCN1.O=C1CC(CO)CCN1
InChIInChI=1S/C50H61N11O6.C34H45N7O3.C33H42BrN7O3.C33H43N7O4.C21H35NO3Si.C14H29NO3Si.C14H27NO3Si.C12H25NO2Si.C6H9NO3.C6H11NO2/c1-32-41-29-52-43(53-47(41)61(37-5-3-4-6-37)50(67)46(32)33(2)62)27-36-7-8-39(28-51-36)58-20-15-55(16-21-58)17-24-59-14-13-34(25-45(59)64)30-56-18-22-57(23-19-56)38-9-10-40-35(26-38)31-60(49(40)66)42-11-12-44(63)54-48(42)65;1-4-25-11-12-40(31(43)19-25)18-15-38-13-16-39(17-14-38)28-10-9-26(35-21-28)20-30-36-22-29-23(2)32(24(3)42)34(44)41(33(29)37-30)27-7-5-6-8-27;1-22-28-21-36-29(37-32(28)41(26-5-3-4-6-26)33(44)31(22)23(2)42)18-25-7-8-27(20-35-25)39-14-11-38(12-15-39)13-16-40-10-9-24(19-34)17-30(40)43;1-22-28-20-35-29(36-32(28)40(26-5-3-4-6-26)33(44)31(22)23(2)42)18-25-7-8-27(19-34-25)38-14-11-37(12-15-38)13-16-39-10-9-24(21-41)17-30(39)43;1-21(2,3)26(4,5)25-17-19-11-12-22(20(23)15-19)13-14-24-16-18-9-7-6-8-10-18;2*1-14(2,3)19(4,5)18-11-12-6-7-15(8-9-16)13(17)10-12;1-12(2,3)16(4,5)15-9-10-6-7-13-11(14)8-10;8-5-3-4(6(9)10)1-2-7-5;8-4-5-1-2-7-6(9)3-5/h7-10,26,28-29,34,37,42H,3-6,11-25,27,30-31H2,1-2H3,(H,54,63,65);9-10,21-22,25,27H,4-8,11-20H2,1-3H3;7-8,20-21,24,26H,3-6,9-19H2,1-2H3;7-8,19-20,24,26,41H,3-6,9-18,21H2,1-2H3;6-10,19H,11-17H2,1-5H3;12,16H,6-11H2,1-5H3;9,12H,6-8,10-11H2,1-5H3;10H,6-9H2,1-5H3,(H,13,14);4H,1-3H2,(H,7,8)(H,9,10);5,8H,1-4H2,(H,7,9)
InChIKeyGTBPZZZHDYXUQJ-UHFFFAOYSA-N
MW4244.55 g/mol
LogP25.22
Rot. Bonds62

About 6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid

6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid (PubChem CID 158357641) has the molecular formula C223H327BrN38O32Si4 and a molecular weight of 4244.55 g/mol. Its IUPAC name is 6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid.

Molecular Properties

Compound Name6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid
PubChem CID158357641
Molecular FormulaC223H327BrN38O32Si4
Molecular Weight4244.55 g/mol
Exact Mass4240.34
IUPAC Name6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid
SMILESCC(=O)c1c(C)c2cnc(Cc3ccc(N4CCN(CCN5CCC(CBr)CC5=O)CC4)cn3)nc2n(C2CCCC2)c1=O.CC(=O)c1c(C)c2cnc(Cc3ccc(N4CCN(CCN5CCC(CN6CCN(c7ccc8c(c7)CN(C7CCC(=O)NC7=O)C8=O)CC6)CC5=O)CC4)cn3)nc2n(C2CCCC2)c1=O.CC(=O)c1c(C)c2cnc(Cc3ccc(N4CCN(CCN5CCC(CO)CC5=O)CC4)cn3)nc2n(C2CCCC2)c1=O.CC(C)(C)[Si](C)(C)OCC1CCN(CC=O)C(=O)C1.CC(C)(C)[Si](C)(C)OCC1CCN(CCO)C(=O)C1.CC(C)(C)[Si](C)(C)OCC1CCN(CCOCc2ccccc2)C(=O)C1.CC(C)(C)[Si](C)(C)OCC1CCNC(=O)C1.CCC1CCN(CCN2CCN(c3ccc(Cc4ncc5c(C)c(C(C)=O)c(=O)n(C6CCCC6)c5n4)nc3)CC2)C(=O)C1.O=C1CC(C(=O)O)CCN1.O=C1CC(CO)CCN1
InChIInChI=1S/C50H61N11O6.C34H45N7O3.C33H42BrN7O3.C33H43N7O4.C21H35NO3Si.C14H29NO3Si.C14H27NO3Si.C12H25NO2Si.C6H9NO3.C6H11NO2/c1-32-41-29-52-43(53-47(41)61(37-5-3-4-6-37)50(67)46(32)33(2)62)27-36-7-8-39(28-51-36)58-20-15-55(16-21-58)17-24-59-14-13-34(25-45(59)64)30-56-18-22-57(23-19-56)38-9-10-40-35(26-38)31-60(49(40)66)42-11-12-44(63)54-48(42)65;1-4-25-11-12-40(31(43)19-25)18-15-38-13-16-39(17-14-38)28-10-9-26(35-21-28)20-30-36-22-29-23(2)32(24(3)42)34(44)41(33(29)37-30)27-7-5-6-8-27;1-22-28-21-36-29(37-32(28)41(26-5-3-4-6-26)33(44)31(22)23(2)42)18-25-7-8-27(20-35-25)39-14-11-38(12-15-39)13-16-40-10-9-24(19-34)17-30(40)43;1-22-28-20-35-29(36-32(28)40(26-5-3-4-6-26)33(44)31(22)23(2)42)18-25-7-8-27(19-34-25)38-14-11-37(12-15-38)13-16-39-10-9-24(21-41)17-30(39)43;1-21(2,3)26(4,5)25-17-19-11-12-22(20(23)15-19)13-14-24-16-18-9-7-6-8-10-18;2*1-14(2,3)19(4,5)18-11-12-6-7-15(8-9-16)13(17)10-12;1-12(2,3)16(4,5)15-9-10-6-7-13-11(14)8-10;8-5-3-4(6(9)10)1-2-7-5;8-4-5-1-2-7-6(9)3-5/h7-10,26,28-29,34,37,42H,3-6,11-25,27,30-31H2,1-2H3,(H,54,63,65);9-10,21-22,25,27H,4-8,11-20H2,1-3H3;7-8,20-21,24,26H,3-6,9-19H2,1-2H3;7-8,19-20,24,26,41H,3-6,9-18,21H2,1-2H3;6-10,19H,11-17H2,1-5H3;12,16H,6-11H2,1-5H3;9,12H,6-8,10-11H2,1-5H3;10H,6-9H2,1-5H3,(H,13,14);4H,1-3H2,(H,7,8)(H,9,10);5,8H,1-4H2,(H,7,9)
InChIKeyGTBPZZZHDYXUQJ-UHFFFAOYSA-N
XLogP25.22
TPSA800.52 Ų
H-Bond Donors8
H-Bond Acceptors57
Rotatable Bonds62
Heavy Atoms298
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004244.55
LogP ≤ 525.22
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1057

Analyze 6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid with MolForge

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Launch Full Analysis

Related Compounds

3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
CID 158357645
(3S)-3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]piperidin-4-yl]methyl]piperidin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
CID 157451133
6-acetyl-8-cyclopentyl-5-methyl-2-[[5-[4-[2-[4-[1-[2-(6-methylidene-2-oxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]piperidin-4-yl]oxypiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]pyrido[2,3-d]pyrimidin-7-one
CID 167703064
6-acetyl-2-[[5-[4-(2-bromoethyl)piperazin-1-yl]-2-pyridinyl]amino]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]piperazin-1-yl]ethyl]piperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;tert-butyl 4-[[4-[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]piperazin-1-yl]methyl]piperidine-1-carboxylate;tert-butyl 4-formylpiperidine-1-carboxylate;hydron;3-(3-oxo-6-piperazin-1-yl-1H-isoindol-2-yl)piperidine-2,6-dione;3-[3-oxo-6-[4-(piperidin-4-ylmethyl)piperazin-1-yl]-1H-isoindol-2-yl]piperidine-2,6-dione;dihydrochloride
CID 161496511
4-[5-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethoxy]-2-oxopentoxy]-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione
CID 161440576
3-[6-[4-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]piperazin-1-yl]butylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
CID 169054498
bis(3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]piperazin-1-yl]ethyl]piperidin-4-yl]methyl]piperidin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione);3-[6-[4-[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]piperazin-1-yl]ethyl]piperidin-4-yl]oxypiperidin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;7-cyclopentyl-2-[[5-[4-[2-[4-[[1-[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]piperidin-4-yl]methyl]piperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]amino]-N,N-dimethylpyrrolo[2,3-d]pyrimidine-6-carboxamide
CID 158151758
6-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazine-1-carbonyl]-16-(2,6-dioxopiperidin-3-yl)-2,3,16-triazatetracyclo[10.7.0.04,9.014,18]nonadeca-1(19),2,4(9),5,7,12,14(18)-heptaene-15,17-dione
CID 164948359
3-[6-[1-[[4-[4-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]piperazin-1-yl]butoxy]phenyl]methyl]piperidin-4-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
CID 166484400
3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]piperazin-1-yl]ethyl]piperidin-4-yl]methyl]piperazin-1-yl]-5,7-difluoro-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
CID 155229386
3-[6-[[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]piperazin-1-yl]methyl]-5-fluoro-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
CID 168871125
2-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]-2-oxoethoxy]acetic acid
CID 160635205

Frequently Asked Questions

What is the IUPAC name of 6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid?
The IUPAC name of 6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid (CID 158357641) is 6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid.
What is the SMILES notation for 6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid?
The canonical SMILES for 6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid is CC(=O)c1c(C)c2cnc(Cc3ccc(N4CCN(CCN5CCC(CBr)CC5=O)CC4)cn3)nc2n(C2CCCC2)c1=O.CC(=O)c1c(C)c2cnc(Cc3ccc(N4CCN(CCN5CCC(CN6CCN(c7ccc8c(c7)CN(C7CCC(=O)NC7=O)C8=O)CC6)CC5=O)CC4)cn3)nc2n(C2CCCC2)c1=O.CC(=O)c1c(C)c2cnc(Cc3ccc(N4CCN(CCN5CCC(CO)CC5=O)CC4)cn3)nc2n(C2CCCC2)c1=O.CC(C)(C)[Si](C)(C)OCC1CCN(CC=O)C(=O)C1.CC(C)(C)[Si](C)(C)OCC1CCN(CCO)C(=O)C1.CC(C)(C)[Si](C)(C)OCC1CCN(CCOCc2ccccc2)C(=O)C1.CC(C)(C)[Si](C)(C)OCC1CCNC(=O)C1.CCC1CCN(CCN2CCN(c3ccc(Cc4ncc5c(C)c(C(C)=O)c(=O)n(C6CCCC6)c5n4)nc3)CC2)C(=O)C1.O=C1CC(C(=O)O)CCN1.O=C1CC(CO)CCN1.
What is the InChIKey of 6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid?
The InChIKey is GTBPZZZHDYXUQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H61N11O6.C34H45N7O3.C33H42BrN7O3.C33H43N7O4.C21H35NO3Si.C14H29NO3Si.C14H27NO3Si.C12H25NO2Si.C6H9NO3.C6H11NO2/c1-32-41-29-52-43(53-47(41)61(37-5-3-4-6-37)50(67)46(32)33(2)62)27-36-7-8-39(28-51-36)58-20-15-55(16-21-58)17-24-59-14-13-34(25-45(59)64)30-56-18-22-57(23-19-56)38-9-10-40-35(26-38)31-60(49(40)66)42-11-12-44(63)54-48(42)65;1-4-25-11-12-40(31(43)19-25)18-15-38-13-16-39(17-14-38)28-10-9-26(35-21-28)20-30-36-22-29-23(2)32(24(3)42)34(44)41(33(29)37-30)27-7-5-6-8-27;1-22-28-21-36-29(37-32(28)41(26-5-3-4-6-26)33(44)31(22)23(2)42)18-25-7-8-27(20-35-25)39-14-11-38(12-15-39)13-16-40-10-9-24(19-34)17-30(40)43;1-22-28-20-35-29(36-32(28)40(26-5-3-4-6-26)33(44)31(22)23(2)42)18-25-7-8-27(19-34-25)38-14-11-37(12-15-38)13-16-39-10-9-24(21-41)17-30(39)43;1-21(2,3)26(4,5)25-17-19-11-12-22(20(23)15-19)13-14-24-16-18-9-7-6-8-10-18;2*1-14(2,3)19(4,5)18-11-12-6-7-15(8-9-16)13(17)10-12;1-12(2,3)16(4,5)15-9-10-6-7-13-11(14)8-10;8-5-3-4(6(9)10)1-2-7-5;8-4-5-1-2-7-6(9)3-5/h7-10,26,28-29,34,37,42H,3-6,11-25,27,30-31H2,1-2H3,(H,54,63,65);9-10,21-22,25,27H,4-8,11-20H2,1-3H3;7-8,20-21,24,26H,3-6,9-19H2,1-2H3;7-8,19-20,24,26,41H,3-6,9-18,21H2,1-2H3;6-10,19H,11-17H2,1-5H3;12,16H,6-11H2,1-5H3;9,12H,6-8,10-11H2,1-5H3;10H,6-9H2,1-5H3,(H,13,14);4H,1-3H2,(H,7,8)(H,9,10);5,8H,1-4H2,(H,7,9).
What are the key properties of 6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid?
6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid has a molecular weight of 4244.55 g/mol, XLogP of 25.22, 62 rotatable bonds, 8 hydrogen bond donors, and 57 hydrogen bond acceptors.
Where does this data come from?
All data for 6-acetyl-2-[[5-[4-[2-[4-(bromomethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-(4-ethyl-2-oxopiperidin-1-yl)ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-acetyl-8-cyclopentyl-2-[[5-[4-[2-[4-(hydroxymethyl)-2-oxopiperidin-1-yl]ethyl]piperazin-1-yl]-2-pyridinyl]methyl]-5-methylpyrido[2,3-d]pyrimidin-7-one;3-[6-[4-[[1-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)methyl]-3-pyridinyl]piperazin-1-yl]ethyl]-2-oxopiperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-hydroxyethyl)piperidin-2-one;2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-oxopiperidin-1-yl]acetaldehyde;4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(2-phenylmethoxyethyl)piperidin-2-one;4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one;4-(hydroxymethyl)piperidin-2-one;2-oxopiperidine-4-carboxylic acid is sourced from PubChem (CID 158357641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).