N,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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

C167H241N69O6S — CID 158060218

IUPACN,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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.C.C.C.CC(C)c1nnc2c(=O)[nH]ccn12.CC(C)c1nnc2c(N)ccnn12.CC(C)n1cnc2c(N(C)C)ncnc21.CC(C)n1cnc2c(N)cccc21.CC(C)n1cnc2c(N)ccnc21.CC(C)n1cnc2c(N)ccnc21.CC(C)n1cnc2c(NCCO)ccnc21.CC(C)n1cnc2ccccc21.CC(C)n1cnc2cnc(NCCO)nc21.CCCNc1ccnc2c1ncn2C(C)C.CNc1ncc2ncn(C(C)C)c2n1.COCc1nc(N)nc2c1ncn2C(C)C.COc1ccnc2c1ncn2C(C)C.CSc1ccnc2c1ncn2C(C)C.Cc1nc(N)c2ncn(C(C)C)c2n1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1ncnc2c1ncn2C(C)C
InChIInChI=1S/C12H18N4.C11H16N4O.2C10H15N5O.C10H15N5.C10H13N3O.C10H13N3S.C10H13N3.C10H12N2.2C9H13N5.C9H12N4O.3C9H12N4.C8H11N5.C8H10N4O.4CH4/c1-4-6-13-10-5-7-14-12-11(10)15-8-16(12)9(2)3;1-8(2)15-7-14-10-9(12-5-6-16)3-4-13-11(10)15;1-6(2)15-5-12-8-7(4-16-3)13-10(11)14-9(8)15;1-7(2)15-6-13-8-5-12-10(11-3-4-16)14-9(8)15;1-7(2)15-6-13-8-9(14(3)4)11-5-12-10(8)15;2*1-7(2)13-6-12-9-8(14-3)4-5-11-10(9)13;1-7(2)13-6-12-10-8(11)4-3-5-9(10)13;1-8(2)12-7-11-9-5-3-4-6-10(9)12;1-6(2)14-5-12-7-4-11-9(10-3)13-8(7)14;1-5(2)14-4-11-7-8(10)12-6(3)13-9(7)14;1-5(2)13-4-10-7-8(13)11-6(3)12-9(7)14;1-6(2)13-5-12-8-7(3)10-4-11-9(8)13;2*1-6(2)13-5-12-8-7(10)3-4-11-9(8)13;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;;;;/h5,7-9H,4,6H2,1-3H3,(H,13,14);3-4,7-8,16H,5-6H2,1-2H3,(H,12,13);5-6H,4H2,1-3H3,(H2,11,13,14);5-7,16H,3-4H2,1-2H3,(H,11,12,14);5-7H,1-4H3;2*4-7H,1-3H3;3-7H,11H2,1-2H3;3-8H,1-2H3;4-6H,1-3H3,(H,10,11,13);4-5H,1-3H3,(H2,10,12,13);4-5H,1-3H3,(H,11,12,14);4-6H,1-3H3;2*3-6H,1-2H3,(H2,10,11);3-5H,9H2,1-2H3;3-5H,1-2H3,(H,9,13);4*1H4
InChIKeyFKNXUZGJDLUXJF-UHFFFAOYSA-N
MW3343.31 g/mol
LogP29.82
Rot. Bonds32

About N,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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

N,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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 158060218) has the molecular formula C167H241N69O6S and a molecular weight of 3343.31 g/mol. Its IUPAC name is N,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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 NameN,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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 CID158060218
Molecular FormulaC167H241N69O6S
Molecular Weight3343.31 g/mol
Exact Mass3341.04
IUPAC NameN,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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.C.C.C.CC(C)c1nnc2c(=O)[nH]ccn12.CC(C)c1nnc2c(N)ccnn12.CC(C)n1cnc2c(N(C)C)ncnc21.CC(C)n1cnc2c(N)cccc21.CC(C)n1cnc2c(N)ccnc21.CC(C)n1cnc2c(N)ccnc21.CC(C)n1cnc2c(NCCO)ccnc21.CC(C)n1cnc2ccccc21.CC(C)n1cnc2cnc(NCCO)nc21.CCCNc1ccnc2c1ncn2C(C)C.CNc1ncc2ncn(C(C)C)c2n1.COCc1nc(N)nc2c1ncn2C(C)C.COc1ccnc2c1ncn2C(C)C.CSc1ccnc2c1ncn2C(C)C.Cc1nc(N)c2ncn(C(C)C)c2n1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1ncnc2c1ncn2C(C)C
InChIInChI=1S/C12H18N4.C11H16N4O.2C10H15N5O.C10H15N5.C10H13N3O.C10H13N3S.C10H13N3.C10H12N2.2C9H13N5.C9H12N4O.3C9H12N4.C8H11N5.C8H10N4O.4CH4/c1-4-6-13-10-5-7-14-12-11(10)15-8-16(12)9(2)3;1-8(2)15-7-14-10-9(12-5-6-16)3-4-13-11(10)15;1-6(2)15-5-12-8-7(4-16-3)13-10(11)14-9(8)15;1-7(2)15-6-13-8-5-12-10(11-3-4-16)14-9(8)15;1-7(2)15-6-13-8-9(14(3)4)11-5-12-10(8)15;2*1-7(2)13-6-12-9-8(14-3)4-5-11-10(9)13;1-7(2)13-6-12-10-8(11)4-3-5-9(10)13;1-8(2)12-7-11-9-5-3-4-6-10(9)12;1-6(2)14-5-12-7-4-11-9(10-3)13-8(7)14;1-5(2)14-4-11-7-8(10)12-6(3)13-9(7)14;1-5(2)13-4-10-7-8(13)11-6(3)12-9(7)14;1-6(2)13-5-12-8-7(3)10-4-11-9(8)13;2*1-6(2)13-5-12-8-7(10)3-4-11-9(8)13;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;;;;/h5,7-9H,4,6H2,1-3H3,(H,13,14);3-4,7-8,16H,5-6H2,1-2H3,(H,12,13);5-6H,4H2,1-3H3,(H2,11,13,14);5-7,16H,3-4H2,1-2H3,(H,11,12,14);5-7H,1-4H3;2*4-7H,1-3H3;3-7H,11H2,1-2H3;3-8H,1-2H3;4-6H,1-3H3,(H,10,11,13);4-5H,1-3H3,(H2,10,12,13);4-5H,1-3H3,(H,11,12,14);4-6H,1-3H3;2*3-6H,1-2H3,(H2,10,11);3-5H,9H2,1-2H3;3-5H,1-2H3,(H,9,13);4*1H4
InChIKeyFKNXUZGJDLUXJF-UHFFFAOYSA-N
XLogP29.82
TPSA917.60 Ų
H-Bond Donors14
H-Bond Acceptors74
Rotatable Bonds32
Heavy Atoms243
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003343.31
LogP ≤ 529.82
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1074

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze N,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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 N,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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 158060218) is N,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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 N,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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 N,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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.C.C.C.CC(C)c1nnc2c(=O)[nH]ccn12.CC(C)c1nnc2c(N)ccnn12.CC(C)n1cnc2c(N(C)C)ncnc21.CC(C)n1cnc2c(N)cccc21.CC(C)n1cnc2c(N)ccnc21.CC(C)n1cnc2c(N)ccnc21.CC(C)n1cnc2c(NCCO)ccnc21.CC(C)n1cnc2ccccc21.CC(C)n1cnc2cnc(NCCO)nc21.CCCNc1ccnc2c1ncn2C(C)C.CNc1ncc2ncn(C(C)C)c2n1.COCc1nc(N)nc2c1ncn2C(C)C.COc1ccnc2c1ncn2C(C)C.CSc1ccnc2c1ncn2C(C)C.Cc1nc(N)c2ncn(C(C)C)c2n1.Cc1nc2c(ncn2C(C)C)c(=O)[nH]1.Cc1ncnc2c1ncn2C(C)C.
What is the InChIKey of N,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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 FKNXUZGJDLUXJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4.C11H16N4O.2C10H15N5O.C10H15N5.C10H13N3O.C10H13N3S.C10H13N3.C10H12N2.2C9H13N5.C9H12N4O.3C9H12N4.C8H11N5.C8H10N4O.4CH4/c1-4-6-13-10-5-7-14-12-11(10)15-8-16(12)9(2)3;1-8(2)15-7-14-10-9(12-5-6-16)3-4-13-11(10)15;1-6(2)15-5-12-8-7(4-16-3)13-10(11)14-9(8)15;1-7(2)15-6-13-8-5-12-10(11-3-4-16)14-9(8)15;1-7(2)15-6-13-8-9(14(3)4)11-5-12-10(8)15;2*1-7(2)13-6-12-9-8(14-3)4-5-11-10(9)13;1-7(2)13-6-12-10-8(11)4-3-5-9(10)13;1-8(2)12-7-11-9-5-3-4-6-10(9)12;1-6(2)14-5-12-7-4-11-9(10-3)13-8(7)14;1-5(2)14-4-11-7-8(10)12-6(3)13-9(7)14;1-5(2)13-4-10-7-8(13)11-6(3)12-9(7)14;1-6(2)13-5-12-8-7(3)10-4-11-9(8)13;2*1-6(2)13-5-12-8-7(10)3-4-11-9(8)13;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;;;;/h5,7-9H,4,6H2,1-3H3,(H,13,14);3-4,7-8,16H,5-6H2,1-2H3,(H,12,13);5-6H,4H2,1-3H3,(H2,11,13,14);5-7,16H,3-4H2,1-2H3,(H,11,12,14);5-7H,1-4H3;2*4-7H,1-3H3;3-7H,11H2,1-2H3;3-8H,1-2H3;4-6H,1-3H3,(H,10,11,13);4-5H,1-3H3,(H2,10,12,13);4-5H,1-3H3,(H,11,12,14);4-6H,1-3H3;2*3-6H,1-2H3,(H2,10,11);3-5H,9H2,1-2H3;3-5H,1-2H3,(H,9,13);4*1H4.
What are the key properties of N,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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?
N,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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 3343.31 g/mol, XLogP of 29.82, 32 rotatable bonds, 14 hydrogen bond donors, and 74 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-9-propan-2-ylpurin-6-amine;methane;6-(methoxymethyl)-9-propan-2-ylpurin-2-amine;7-methoxy-3-propan-2-ylimidazo[4,5-b]pyridine;2-methyl-9-propan-2-ylpurin-6-amine;N-methyl-9-propan-2-ylpurin-2-amine;6-methyl-9-propan-2-ylpurine;2-methyl-9-propan-2-yl-1H-purin-6-one;7-methylsulfanyl-3-propan-2-ylimidazo[4,5-b]pyridine;1-propan-2-ylbenzimidazol-4-amine;1-propan-2-ylbenzimidazole;bis(3-propan-2-ylimidazo[4,5-b]pyridin-7-amine);2-[(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)amino]ethanol;3-propan-2-yl-N-propylimidazo[4,5-b]pyridin-7-amine;2-[(9-propan-2-ylpurin-2-yl)amino]ethanol;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 158060218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).