ethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane)

C157H239N21O18 — CID 164954923

IUPACethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane)
SMILESC=C1CCC(N2C(=O)Cc3ccccc32)C(=O)N1.C=C1CCC(N2CC(c3ccccc3)N(C(C)C)C2=O)C(=O)N1.C=C1CCC(N2CC(c3ccccc3)N(C(C)C)C2=O)C(=O)N1.C=C1CCC(N2CC(c3ccccc3)N(C)C2=O)C(=O)N1.C=C1CCC(N2CC(c3ccccc3)OC2=O)C(=O)N1.C=C1CCC(N2CCN(c3ccccc3)C2=O)C(=O)N1.C=C1CCC(n2c(=O)oc3ccccc32)C(=O)N1.C=C1CCC(n2ccn(C(C)C)c2=O)C(=O)N1.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C
InChIInChI=1S/2C18H23N3O2.C16H19N3O2.C15H17N3O2.C15H16N2O3.C14H14N2O2.C13H12N2O3.C12H17N3O2.5C4H10.8C2H6/c2*1-12(2)21-16(14-7-5-4-6-8-14)11-20(18(21)23)15-10-9-13(3)19-17(15)22;1-11-8-9-13(15(20)17-11)19-10-14(18(2)16(19)21)12-6-4-3-5-7-12;1-11-7-8-13(14(19)16-11)18-10-9-17(15(18)20)12-5-3-2-4-6-12;1-10-7-8-12(14(18)16-10)17-9-13(20-15(17)19)11-5-3-2-4-6-11;1-9-6-7-12(14(18)15-9)16-11-5-3-2-4-10(11)8-13(16)17;1-8-6-7-10(12(16)14-8)15-9-4-2-3-5-11(9)18-13(15)17;1-8(2)14-6-7-15(12(14)17)10-5-4-9(3)13-11(10)16;5*1-4(2)3;8*1-2/h2*4-8,12,15-16H,3,9-11H2,1-2H3,(H,19,22);3-7,13-14H,1,8-10H2,2H3,(H,17,20);2-6,13H,1,7-10H2,(H,16,19);2-6,12-13H,1,7-9H2,(H,16,18);2-5,12H,1,6-8H2,(H,15,18);2-5,10H,1,6-7H2,(H,14,16);6-8,10H,3-5H2,1-2H3,(H,13,16);5*4H,1-3H3;8*1-2H3
InChIKeyBAXGGECDNIMICQ-UHFFFAOYSA-N
MW2708.77 g/mol
LogP31.56
Rot. Bonds16

About ethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane)

ethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane) (PubChem CID 164954923) has the molecular formula C157H239N21O18 and a molecular weight of 2708.77 g/mol. Its IUPAC name is ethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane).

Molecular Properties

Compound Nameethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane)
PubChem CID164954923
Molecular FormulaC157H239N21O18
Molecular Weight2708.77 g/mol
Exact Mass2706.84
IUPAC Nameethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane)
SMILESC=C1CCC(N2C(=O)Cc3ccccc32)C(=O)N1.C=C1CCC(N2CC(c3ccccc3)N(C(C)C)C2=O)C(=O)N1.C=C1CCC(N2CC(c3ccccc3)N(C(C)C)C2=O)C(=O)N1.C=C1CCC(N2CC(c3ccccc3)N(C)C2=O)C(=O)N1.C=C1CCC(N2CC(c3ccccc3)OC2=O)C(=O)N1.C=C1CCC(N2CCN(c3ccccc3)C2=O)C(=O)N1.C=C1CCC(n2c(=O)oc3ccccc32)C(=O)N1.C=C1CCC(n2ccn(C(C)C)c2=O)C(=O)N1.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C
InChIInChI=1S/2C18H23N3O2.C16H19N3O2.C15H17N3O2.C15H16N2O3.C14H14N2O2.C13H12N2O3.C12H17N3O2.5C4H10.8C2H6/c2*1-12(2)21-16(14-7-5-4-6-8-14)11-20(18(21)23)15-10-9-13(3)19-17(15)22;1-11-8-9-13(15(20)17-11)19-10-14(18(2)16(19)21)12-6-4-3-5-7-12;1-11-7-8-13(14(19)16-11)18-10-9-17(15(18)20)12-5-3-2-4-6-12;1-10-7-8-12(14(18)16-10)17-9-13(20-15(17)19)11-5-3-2-4-6-11;1-9-6-7-12(14(18)15-9)16-11-5-3-2-4-10(11)8-13(16)17;1-8-6-7-10(12(16)14-8)15-9-4-2-3-5-11(9)18-13(15)17;1-8(2)14-6-7-15(12(14)17)10-5-4-9(3)13-11(10)16;5*1-4(2)3;8*1-2/h2*4-8,12,15-16H,3,9-11H2,1-2H3,(H,19,22);3-7,13-14H,1,8-10H2,2H3,(H,17,20);2-6,13H,1,7-10H2,(H,16,19);2-6,12-13H,1,7-9H2,(H,16,18);2-5,12H,1,6-8H2,(H,15,18);2-5,10H,1,6-7H2,(H,14,16);6-8,10H,3-5H2,1-2H3,(H,13,16);5*4H,1-3H3;8*1-2H3
InChIKeyBAXGGECDNIMICQ-UHFFFAOYSA-N
XLogP31.56
TPSA438.92 Ų
H-Bond Donors8
H-Bond Acceptors21
Rotatable Bonds16
Heavy Atoms196
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002708.77
LogP ≤ 531.56
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1021

Analyze ethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane) with MolForge

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Related Compounds

(2S)-N-[(3S,9S,13S,15R,19S,22S)-15,19-dimethyl-2,8,12,18,21-pentaoxo-11-oxa-1,7,17,20-tetrazatetracyclo[20.4.0.03,7.013,17]hexacosan-9-yl]-2-[[2-(3-ethylphenyl)acetyl]amino]-3-phenylpropanamide;(2S)-N-[(3S,9S,13S,15R,19S,22S)-15,19-dimethyl-2,8,12,18,21-pentaoxo-11-oxa-1,7,17,20-tetrazatetracyclo[20.4.0.03,7.013,17]hexacosan-9-yl]-2-[[2-(3-methoxyphenyl)acetyl]amino]-3-phenylpropanamide;(2S)-N-[(3S,9S,13S,15R,19S,22S)-15,19-dimethyl-2,8,12,18,21-pentaoxo-11-oxa-1,7,17,20-tetrazatetracyclo[20.4.0.03,7.013,17]hexacosan-9-yl]-2-[[2-(1-methyl-2,3-dihydroindol-5-yl)acetyl]amino]-3-phenylpropanamide;(2S)-N-[(3S,9S,13S,15R,19S,22S)-15,19-dimethyl-2,8,12,18,21-pentaoxo-11-oxa-1,7,17,20-tetrazatetracyclo[20.4.0.03,7.013,17]hexacosan-9-yl]-2-[[2-(3-methylphenyl)acetyl]amino]-3-phenylpropanamide
CID 157257899
2-[4-[(2S,4S)-1-[2-[4-[(2-aminophenyl)carbamoylamino]-3-methoxyphenyl]acetyl]-4-hydroxypyrrolidine-2-carbonyl]piperazin-1-yl]acetic acid;2-[4-[(2S,4S)-4-hydroxy-1-[2-[4-[(2-hydroxyphenyl)carbamoylamino]-3-methoxyphenyl]acetyl]pyrrolidine-2-carbonyl]piperazin-1-yl]acetic acid;2-[1-[(2S,4S)-4-methoxy-1-[2-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]pyrrolidine-2-carbonyl]piperidin-4-yl]acetic acid;2-[1-[1-[2-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carbonyl]piperidin-4-yl]acetic acid;2-[1-[1-[2-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]-2,3-dihydroindole-2-carbonyl]piperidin-4-yl]acetic acid;2-[4-[2-[2-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]piperazin-1-yl]acetic acid
CID 157384169
3-Methyl-6-(4-methylpiperazine-1-carbonyl)-1,3-diazinane-2,4-dione;1-methyl-3-(4-methylpiperazine-1-carbonyl)pyridin-2-one;1-methyl-4-(4-methylpiperazine-1-carbonyl)pyridin-2-one;6-(4-methylpiperazine-1-carbonyl)-1,3-diazinane-2,4-dione;2-(4-methylpiperazine-1-carbonyl)pyrrolidine-1-carboxamide;3-(4-methylpiperazine-1-carbonyl)pyrrolidin-2-one;1-(4-methylpiperazin-1-yl)-2-morpholin-4-ylethanone;5-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]imidazolidin-2-one;3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]pyrrolidine-2,5-dione;3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-1,3-benzoxazol-2-one
CID 157832217
3-(4-amino-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(3-cyclopropyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;1-cyclopropyl-3-(6-oxopiperidin-3-yl)benzimidazol-2-one;3-(3-ethyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;1-ethyl-3-(6-oxopiperidin-3-yl)benzimidazol-2-one;1-methyl-3-(6-oxopiperidin-3-yl)benzimidazol-2-one;3-(2-oxo-3H-indol-1-yl)piperidine-2,6-dione;3-(6-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;2-(6-oxopiperidin-3-yl)-3,4-dihydroisoquinolin-1-one;1-(6-oxopiperidin-3-yl)-3H-indol-2-one
CID 158289606
2-[4-[4-Hydroxy-1-[2-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]pyrrolidine-2-carbonyl]piperazin-1-yl]acetic acid;4-[1-[2-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]pyrrolidine-2-carbonyl]piperazine-1-carboxylic acid;2-[1-[2-[2-[4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]-1,3-dihydroisoindole-1-carbonyl]piperidin-4-yl]acetic acid
CID 159237285
2-[4-[(2S,4R)-1-[2-[4-[(2-aminophenyl)carbamoylamino]-3-methoxyphenyl]acetyl]-4-hydroxypyrrolidine-2-carbonyl]piperazin-1-yl]acetic acid;2-[4-[(2S,4R)-4-hydroxy-1-[2-[4-[(2-hydroxyphenyl)carbamoylamino]-3-methoxyphenyl]acetyl]pyrrolidine-2-carbonyl]piperazin-1-yl]acetic acid;2-[4-[(2S,4R)-4-methoxy-1-[2-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]pyrrolidine-2-carbonyl]piperazin-1-yl]acetic acid;2-[1-[1-[2-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carbonyl]piperidin-4-yl]acetic acid;2-[1-[1-[2-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]-2,3-dihydroindole-2-carbonyl]piperidin-4-yl]acetic acid;2-[4-[2-[2-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]piperazin-1-yl]acetic acid
CID 159239725
ethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;tetrakis(2-methylpropane)
CID 165067283
6-(8-azabicyclo[3.2.1]octan-3-yl)-3-methyl-1,3-benzoxazol-2-one;6-cyclohexyl-3-methyl-1,3-benzoxazol-2-one;3-[2-(dimethylamino)ethyl]-6-(2,2-dimethylpiperidin-4-yl)-1,3-benzoxazol-2-one;6-(2,2-dimethylpiperidin-4-yl)-3-methyl-1,3-benzoxazol-2-one;3-methyl-6-[(2R)-2-methylpiperidin-4-yl]-1,3-benzoxazol-2-one;3-methyl-6-[(2S)-2-methylpiperidin-4-yl]-1,3-benzoxazol-2-one;3-methyl-6-(2-methylpiperidin-4-yl)-1,3-benzoxazol-2-one;3-methyl-6-(2-oxa-5-azaspiro[3.5]nonan-8-yl)-1,3-benzoxazol-2-one;3-methyl-6-(2-oxopiperidin-4-yl)-1,3-benzoxazol-2-one;3-methyl-4-piperidin-4-yl-1,3-benzoxazol-2-one;3-methyl-5-piperidin-4-yl-1,3-benzoxazol-2-one;3-methyl-6-piperidin-4-yl-1,3-benzoxazol-2-one;3-methyl-7-piperidin-4-yl-1,3-benzoxazol-2-one;3-(1-methylpiperidin-4-yl)-6-piperidin-4-yl-1,3-benzoxazol-2-one
CID 167535939
6-(8-Azabicyclo[3.2.1]octan-3-yl)-3-methyl-1,3-benzoxazol-2-one;6-(5-azaspiro[3.5]nonan-8-yl)-3-methyl-1,3-benzoxazol-2-one;3-[2-(dimethylamino)ethyl]-6-(2,2-dimethylpiperidin-4-yl)-1,3-benzoxazol-2-one;3-methyl-6-(2-oxopiperidin-4-yl)-1,3-benzoxazol-2-one
CID 167572338
1-(6-methylidene-2-oxopiperidin-3-yl)-3-propan-2-ylbenzimidazol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-6-propan-2-yl-1,3-benzoxazol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-7-propan-2-yl-1,3-benzoxazol-2-one;1-methyl-3-(6-methylidene-2-oxopiperidin-3-yl)-5-propan-2-ylbenzimidazol-2-one;3-methyl-1-[(3S)-6-methylidene-2-oxopiperidin-3-yl]-4-propan-2-ylbenzimidazol-2-one;3-methyl-1-[(3R)-6-methylidene-2-oxopiperidin-3-yl]-4-propan-2-ylbenzimidazol-2-one;3-methyl-1-[(3S)-6-methylidene-2-oxopiperidin-3-yl]-5-propan-2-ylbenzimidazol-2-one;3-methyl-1-[(3R)-6-methylidene-2-oxopiperidin-3-yl]-5-propan-2-ylbenzimidazol-2-one;3-methyl-1-(6-methylidene-2-oxopiperidin-3-yl)-4-propan-2-ylbenzimidazol-2-one;3-methyl-1-(6-methylidene-2-oxopiperidin-3-yl)-5-propan-2-ylbenzimidazol-2-one
CID 167600021
1-(6-Methylidene-2-oxopiperidin-3-yl)-3-propan-2-ylbenzimidazol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-6-propan-2-yl-1,3-benzoxazol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-7-propan-2-yl-1,3-benzoxazol-2-one;bis(2-(6-methylidene-2-oxopiperidin-3-yl)-4-propan-2-ylisoindole-1,3-dione);bis(2-(6-methylidene-2-oxopiperidin-3-yl)-5-propan-2-ylisoindole-1,3-dione);3-methyl-1-(6-methylidene-2-oxopiperidin-3-yl)-4-propan-2-ylbenzimidazol-2-one;3-methyl-1-(6-methylidene-2-oxopiperidin-3-yl)-5-propan-2-ylbenzimidazol-2-one
CID 167679917

Frequently Asked Questions

What is the IUPAC name of ethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane)?
The IUPAC name of ethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane) (CID 164954923) is ethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane).
What is the SMILES notation for ethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane)?
The canonical SMILES for ethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane) is C=C1CCC(N2C(=O)Cc3ccccc32)C(=O)N1.C=C1CCC(N2CC(c3ccccc3)N(C(C)C)C2=O)C(=O)N1.C=C1CCC(N2CC(c3ccccc3)N(C(C)C)C2=O)C(=O)N1.C=C1CCC(N2CC(c3ccccc3)N(C)C2=O)C(=O)N1.C=C1CCC(N2CC(c3ccccc3)OC2=O)C(=O)N1.C=C1CCC(N2CCN(c3ccccc3)C2=O)C(=O)N1.C=C1CCC(n2c(=O)oc3ccccc32)C(=O)N1.C=C1CCC(n2ccn(C(C)C)c2=O)C(=O)N1.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.
What is the InChIKey of ethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane)?
The InChIKey is BAXGGECDNIMICQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C18H23N3O2.C16H19N3O2.C15H17N3O2.C15H16N2O3.C14H14N2O2.C13H12N2O3.C12H17N3O2.5C4H10.8C2H6/c2*1-12(2)21-16(14-7-5-4-6-8-14)11-20(18(21)23)15-10-9-13(3)19-17(15)22;1-11-8-9-13(15(20)17-11)19-10-14(18(2)16(19)21)12-6-4-3-5-7-12;1-11-7-8-13(14(19)16-11)18-10-9-17(15(18)20)12-5-3-2-4-6-12;1-10-7-8-12(14(18)16-10)17-9-13(20-15(17)19)11-5-3-2-4-6-11;1-9-6-7-12(14(18)15-9)16-11-5-3-2-4-10(11)8-13(16)17;1-8-6-7-10(12(16)14-8)15-9-4-2-3-5-11(9)18-13(15)17;1-8(2)14-6-7-15(12(14)17)10-5-4-9(3)13-11(10)16;5*1-4(2)3;8*1-2/h2*4-8,12,15-16H,3,9-11H2,1-2H3,(H,19,22);3-7,13-14H,1,8-10H2,2H3,(H,17,20);2-6,13H,1,7-10H2,(H,16,19);2-6,12-13H,1,7-9H2,(H,16,18);2-5,12H,1,6-8H2,(H,15,18);2-5,10H,1,6-7H2,(H,14,16);6-8,10H,3-5H2,1-2H3,(H,13,16);5*4H,1-3H3;8*1-2H3.
What are the key properties of ethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane)?
ethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane) has a molecular weight of 2708.77 g/mol, XLogP of 31.56, 16 rotatable bonds, 8 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-methylidene-3-(3-methyl-2-oxo-4-phenylimidazolidin-1-yl)piperidin-2-one;6-methylidene-3-(2-oxo-3-phenylimidazolidin-1-yl)piperidin-2-one;bis(6-methylidene-3-(2-oxo-4-phenyl-3-propan-2-ylimidazolidin-1-yl)piperidin-2-one);3-(6-methylidene-2-oxopiperidin-3-yl)-1,3-benzoxazol-2-one;1-(6-methylidene-2-oxopiperidin-3-yl)-3H-indol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-5-phenyl-1,3-oxazolidin-2-one;6-methylidene-3-(2-oxo-3-propan-2-ylimidazol-1-yl)piperidin-2-one;pentakis(2-methylpropane) is sourced from PubChem (CID 164954923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).