8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine

C128H172F3N55O10 — CID 158030937

IUPAC8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine
SMILESC.CC(C)c1nnc2c(=O)[nH]ccn12.CC(C)c1nnc2c(N)ccnn12.CC(C)n1c(F)nc2c(N)ncnc21.CC(C)n1ccc2c(=O)[nH]ncc21.CC1=NC2C(C=CN2C(C)C)C(=O)N1.Cc1cc(=O)c2ncn(C(C)C)c2[nH]1.Cc1cc(N)c2ncn(C(C)C)c2n1.Cc1nc(N)c2ncn(C(C)C)c2n1.Cc1nc2c(c(F)cn2C(C)C)c(=O)[nH]1.Cc1nc2c(nc(F)n2C(C)C)c(=O)[nH]1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1
InChIInChI=1S/C10H12FN3O.C10H14N4.C10H13N3O.C10H15N3O.C9H11FN4O.C9H13N5.4C9H12N4O.C9H11N3O.C8H10FN5.C8H11N5.C8H10N4O.CH4/c1-5(2)14-4-7(11)8-9(14)12-6(3)13-10(8)15;1-6(2)14-5-12-9-8(11)4-7(3)13-10(9)14;1-6(2)13-5-11-9-8(14)4-7(3)12-10(9)13;1-6(2)13-5-4-8-9(13)11-7(3)12-10(8)14;1-4(2)14-7-6(13-9(14)10)8(15)12-5(3)11-7;1-5(2)14-4-11-7-8(10)12-6(3)13-9(7)14;4*1-5(2)13-4-10-7-8(13)11-6(3)12-9(7)14;1-6(2)12-4-3-7-8(12)5-10-11-9(7)13;1-4(2)14-7-5(13-8(14)9)6(10)11-3-12-7;1-5(2)7-11-12-8-6(9)3-4-10-13(7)8;1-5(2)6-10-11-7-8(13)9-3-4-12(6)7;/h4-5H,1-3H3,(H,12,13,15);4-6H,1-3H3,(H2,11,13);4-6H,1-3H3,(H,12,14);4-6,8-9H,1-3H3,(H,11,12,14);4H,1-3H3,(H,11,12,15);4-5H,1-3H3,(H2,10,12,13);4*4-5H,1-3H3,(H,11,12,14);3-6H,1-2H3,(H,11,13);3-4H,1-2H3,(H2,10,11,12);3-5H,9H2,1-2H3;3-5H,1-2H3,(H,9,13);1H4
InChIKeyFHEABFQCPCEGMO-UHFFFAOYSA-N
MW2698.15 g/mol
LogP16.91
Rot. Bonds14

About 8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine

8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine (PubChem CID 158030937) has the molecular formula C128H172F3N55O10 and a molecular weight of 2698.15 g/mol. Its IUPAC name is 8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine.

Molecular Properties

Compound Name8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine
PubChem CID158030937
Molecular FormulaC128H172F3N55O10
Molecular Weight2698.15 g/mol
Exact Mass2696.46
IUPAC Name8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine
SMILESC.CC(C)c1nnc2c(=O)[nH]ccn12.CC(C)c1nnc2c(N)ccnn12.CC(C)n1c(F)nc2c(N)ncnc21.CC(C)n1ccc2c(=O)[nH]ncc21.CC1=NC2C(C=CN2C(C)C)C(=O)N1.Cc1cc(=O)c2ncn(C(C)C)c2[nH]1.Cc1cc(N)c2ncn(C(C)C)c2n1.Cc1nc(N)c2ncn(C(C)C)c2n1.Cc1nc2c(c(F)cn2C(C)C)c(=O)[nH]1.Cc1nc2c(nc(F)n2C(C)C)c(=O)[nH]1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1
InChIInChI=1S/C10H12FN3O.C10H14N4.C10H13N3O.C10H15N3O.C9H11FN4O.C9H13N5.4C9H12N4O.C9H11N3O.C8H10FN5.C8H11N5.C8H10N4O.CH4/c1-5(2)14-4-7(11)8-9(14)12-6(3)13-10(8)15;1-6(2)14-5-12-9-8(11)4-7(3)13-10(9)14;1-6(2)13-5-11-9-8(14)4-7(3)12-10(9)13;1-6(2)13-5-4-8-9(13)11-7(3)12-10(8)14;1-4(2)14-7-6(13-9(14)10)8(15)12-5(3)11-7;1-5(2)14-4-11-7-8(10)12-6(3)13-9(7)14;4*1-5(2)13-4-10-7-8(13)11-6(3)12-9(7)14;1-6(2)12-4-3-7-8(12)5-10-11-9(7)13;1-4(2)14-7-5(13-8(14)9)6(10)11-3-12-7;1-5(2)7-11-12-8-6(9)3-4-10-13(7)8;1-5(2)6-10-11-7-8(13)9-3-4-12(6)7;/h4-5H,1-3H3,(H,12,13,15);4-6H,1-3H3,(H2,11,13);4-6H,1-3H3,(H,12,14);4-6,8-9H,1-3H3,(H,11,12,14);4H,1-3H3,(H,11,12,15);4-5H,1-3H3,(H2,10,12,13);4*4-5H,1-3H3,(H,11,12,14);3-6H,1-2H3,(H,11,13);3-4H,1-2H3,(H2,10,11,12);3-5H,9H2,1-2H3;3-5H,1-2H3,(H,9,13);1H4
InChIKeyFHEABFQCPCEGMO-UHFFFAOYSA-N
XLogP16.91
TPSA842.71 Ų
H-Bond Donors14
H-Bond Acceptors55
Rotatable Bonds14
Heavy Atoms196
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002698.15
LogP ≤ 516.91
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1055

Analyze 8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine with MolForge

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Related Compounds

2-fluoro-N-(6-(4-(4-fluorophenyl)-1-(1-(1-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl)-1H-imidazol-5-yl)imidazo[1,2-b]pyridazin-2-yl)isonicotinamide
CID 118538666
N-(6-(1-(1-(1H-imidazole-4-carbonyl)piperidin-4-yl)-4-(4-fluorophenyl)-1H-imidazol-5-yl)imidazo(1,2-b]pyridazin-2-yl)-2-fluoroisonicotinamide
CID 118538686
N-(6-(2-cyclopropyl-4-(4-fluorophenyl)-1-(1-(pyridin-4-ylcarbamoyl)piperidin-4-yl)-1H-imidazol-5-yl)imidazo[1,2-b]pyridazin-2-yl)-2-fluoroisonicotinamide
CID 118538771
N-(6-(1-(1-((1H-pyrazol-5-yl)methyl)piperidin-4-yl)-4-(4-fluorophenyl)-1H-imidazol-5-yl)imidazo[1,2-b]pyridazin-2-yl)-2-fluoroisonicotinamide
CID 118539006
2-fluoro-N-(6-(4-(4-fluorophenyl)-1-(1-((1-methylpiperidin-4-yl)methyl)piperidin-4-yl)-1H-imidazol-5-yl)imidazo[1,2-6]pyridazin-2-yl)isonicotinamide
CID 118547765
2-amino-6-fluoro-N-[4-[6-(4-pyrrolidin-1-ylpiperidine-1-carbonyl)-3-pyridinyl]-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 90200075
N-(6-(2-cyclopropyl-4-(4-fluorophenyl)-1-(1-((1-methyl-1H-pyrazol-5-yl)methyl)piperidin-4-yl)-1H-imidazol-5-yl)imidazo[1,2-b] pyridazin-2-yl)-2-fluoroisonicotinamide
CID 118538683
6-(2,6-dioxopiperidin-3-yl)-3-methylpyrrolo[3,4-b]pyrazine-5,7-dione;6-(2,6-dioxopiperidin-3-yl)-3-methylpyrrolo[3,4-b]pyridine-5,7-dione;3-(4-fluoro-3-methyl-7-oxo-5H-pyrrolo[3,4-b]pyridin-6-yl)piperidine-2,6-dione;3-(3-methyl-5-oxo-7H-pyrrolo[3,4-b]pyrazin-6-yl)piperidine-2,6-dione;3-(3-methyl-7-oxo-5H-pyrrolo[3,4-b]pyrazin-6-yl)piperidine-2,6-dione;3-(3-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl)piperidine-2,6-dione;3-(3-methyl-7-oxo-5H-pyrrolo[3,4-b]pyridin-6-yl)piperidine-2,6-dione;3-(2-methyl-5-oxo-7H-pyrrolo[3,4-d]pyrimidin-6-yl)piperidine-2,6-dione
CID 167676231
US12473304, Example 43
CID 156829076
US12473304, Example 287
CID 156829334
US12473304, Example 273
CID 156829519
US12473304, Example 264
CID 156829900

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine?
The IUPAC name of 8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine (CID 158030937) is 8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine.
What is the SMILES notation for 8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine?
The canonical SMILES for 8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine is C.CC(C)c1nnc2c(=O)[nH]ccn12.CC(C)c1nnc2c(N)ccnn12.CC(C)n1c(F)nc2c(N)ncnc21.CC(C)n1ccc2c(=O)[nH]ncc21.CC1=NC2C(C=CN2C(C)C)C(=O)N1.Cc1cc(=O)c2ncn(C(C)C)c2[nH]1.Cc1cc(N)c2ncn(C(C)C)c2n1.Cc1nc(N)c2ncn(C(C)C)c2n1.Cc1nc2c(c(F)cn2C(C)C)c(=O)[nH]1.Cc1nc2c(nc(F)n2C(C)C)c(=O)[nH]1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.
What is the InChIKey of 8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine?
The InChIKey is FHEABFQCPCEGMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN3O.C10H14N4.C10H13N3O.C10H15N3O.C9H11FN4O.C9H13N5.4C9H12N4O.C9H11N3O.C8H10FN5.C8H11N5.C8H10N4O.CH4/c1-5(2)14-4-7(11)8-9(14)12-6(3)13-10(8)15;1-6(2)14-5-12-9-8(11)4-7(3)13-10(9)14;1-6(2)13-5-11-9-8(14)4-7(3)12-10(9)13;1-6(2)13-5-4-8-9(13)11-7(3)12-10(8)14;1-4(2)14-7-6(13-9(14)10)8(15)12-5(3)11-7;1-5(2)14-4-11-7-8(10)12-6(3)13-9(7)14;4*1-5(2)13-4-10-7-8(13)11-6(3)12-9(7)14;1-6(2)12-4-3-7-8(12)5-10-11-9(7)13;1-4(2)14-7-5(13-8(14)9)6(10)11-3-12-7;1-5(2)7-11-12-8-6(9)3-4-10-13(7)8;1-5(2)6-10-11-7-8(13)9-3-4-12(6)7;/h4-5H,1-3H3,(H,12,13,15);4-6H,1-3H3,(H2,11,13);4-6H,1-3H3,(H,12,14);4-6,8-9H,1-3H3,(H,11,12,14);4H,1-3H3,(H,11,12,15);4-5H,1-3H3,(H2,10,12,13);4*4-5H,1-3H3,(H,11,12,14);3-6H,1-2H3,(H,11,13);3-4H,1-2H3,(H2,10,11,12);3-5H,9H2,1-2H3;3-5H,1-2H3,(H,9,13);1H4.
What are the key properties of 8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine?
8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine has a molecular weight of 2698.15 g/mol, XLogP of 16.91, 14 rotatable bonds, 14 hydrogen bond donors, and 55 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-2-methyl-9-propan-2-yl-1H-purin-6-one;5-fluoro-2-methyl-7-propan-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one;8-fluoro-9-propan-2-ylpurin-6-amine;methane;2-methyl-7-propan-2-yl-4a,7a-dihydro-3H-pyrrolo[2,3-d]pyrimidin-4-one;5-methyl-3-propan-2-ylimidazo[4,5-b]pyridin-7-amine;5-methyl-3-propan-2-yl-4H-imidazo[4,5-b]pyridin-7-one;2-methyl-9-propan-2-ylpurin-6-amine;tetrakis(2-methyl-9-propan-2-yl-1H-purin-6-one);1-propan-2-yl-5H-pyrrolo[2,3-d]pyridazin-4-one;3-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine is sourced from PubChem (CID 158030937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).