4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine

C172H207FN60O5S5 — CID 158503241

IUPAC4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine
SMILESCc1c(F)ccc2[nH]ccc12.Cc1cc(N)n[nH]1.Cc1cc2cc[nH]c2cn1.Cc1ccc(N)s1.Cc1ccc2[nH]ccc2c1.Cc1ccc2[nH]ccc2n1.Cc1ccc2[nH]ncc2c1.Cc1cccc2[nH]ccc12.Cc1cccc2[nH]ncc12.Cc1ccnc2[nH]ccc12.Cc1ccnc2[nH]ncc12.Cc1ccsc1N.Cc1cn[nH]c1N.Cc1cnc(N)[nH]1.Cc1cnc(N)o1.Cc1cnc2[nH]ccc2c1.Cc1cnc2[nH]ncc2c1.Cc1cnc2cc[nH]c2c1.Cc1cncc2[nH]ncc12.Cc1coc(N)n1.Cc1csc(N)c1.Cc1nc(N)[nH]c1C.Cc1nc(N)oc1C.Cc1nc(N)oc1C.Cc1nc(N)sc1C.Cc1nccc2[nH]ncc12.Cc1nnc(N)s1.Cc1noc(N)n1
InChIInChI=1S/C9H8FN.2C9H9N.7C8H8N2.4C7H7N3.C5H9N3.2C5H8N2O.C5H8N2S.3C5H7NS.3C4H7N3.2C4H6N2O.C3H5N3O.C3H5N3S/c1-6-7-4-5-11-9(7)3-2-8(6)10;1-7-2-3-9-8(6-7)4-5-10-9;1-7-3-2-4-9-8(7)5-6-10-9;1-6-2-4-9-8-7(6)3-5-10-8;1-6-4-7-2-3-9-8(7)5-10-6;1-6-4-8-7(10-5-6)2-3-9-8;1-6-4-7-2-3-9-8(7)10-5-6;1-6-2-3-8-7(4-6)5-9-10-8;1-6-2-3-7-8(10-6)4-5-9-7;1-6-3-2-4-8-7(6)5-9-10-8;1-5-2-8-4-7-6(5)3-9-10-7;1-5-2-6-4-9-10-7(6)8-3-5;1-5-6-4-9-10-7(6)2-3-8-5;1-5-2-3-8-7-6(5)4-9-10-7;4*1-3-4(2)8-5(6)7-3;1-4-2-5(6)7-3-4;1-4-2-3-7-5(4)6;1-4-2-3-5(6)7-4;1-3-2-6-4(5)7-3;1-3-2-6-7-4(3)5;1-3-2-4(5)7-6-3;1-3-2-7-4(5)6-3;1-3-2-6-4(5)7-3;1-2-5-3(4)7-6-2;1-2-5-6-3(4)7-2/h2-5,11H,1H3;2*2-6,10H,1H3;2-5H,1H3,(H,9,10);2*2-5,9H,1H3;2*2-5H,1H3,(H,9,10);2-5,9H,1H3;2-5H,1H3,(H,9,10);2-4H,1H3,(H,9,10);2-4H,1H3,(H,8,9,10);2-4H,1H3,(H,9,10);2-4H,1H3,(H,8,9,10);1-2H3,(H3,6,7,8);3*1-2H3,(H2,6,7);3*2-3H,6H2,1H3;3*2H,1H3,(H3,5,6,7);2*2H,1H3,(H2,5,6);1H3,(H2,4,5,6);1H3,(H2,4,6)
InChIKeyHKDSLHMUQINNBR-UHFFFAOYSA-N
MW3374.30 g/mol
LogP36.77
Rot. Bonds

About 4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine

4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine (PubChem CID 158503241) has the molecular formula C172H207FN60O5S5 and a molecular weight of 3374.30 g/mol. Its IUPAC name is 4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine.

Molecular Properties

Compound Name4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine
PubChem CID158503241
Molecular FormulaC172H207FN60O5S5
Molecular Weight3374.30 g/mol
Exact Mass3371.64
IUPAC Name4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine
SMILESCc1c(F)ccc2[nH]ccc12.Cc1cc(N)n[nH]1.Cc1cc2cc[nH]c2cn1.Cc1ccc(N)s1.Cc1ccc2[nH]ccc2c1.Cc1ccc2[nH]ccc2n1.Cc1ccc2[nH]ncc2c1.Cc1cccc2[nH]ccc12.Cc1cccc2[nH]ncc12.Cc1ccnc2[nH]ccc12.Cc1ccnc2[nH]ncc12.Cc1ccsc1N.Cc1cn[nH]c1N.Cc1cnc(N)[nH]1.Cc1cnc(N)o1.Cc1cnc2[nH]ccc2c1.Cc1cnc2[nH]ncc2c1.Cc1cnc2cc[nH]c2c1.Cc1cncc2[nH]ncc12.Cc1coc(N)n1.Cc1csc(N)c1.Cc1nc(N)[nH]c1C.Cc1nc(N)oc1C.Cc1nc(N)oc1C.Cc1nc(N)sc1C.Cc1nccc2[nH]ncc12.Cc1nnc(N)s1.Cc1noc(N)n1
InChIInChI=1S/C9H8FN.2C9H9N.7C8H8N2.4C7H7N3.C5H9N3.2C5H8N2O.C5H8N2S.3C5H7NS.3C4H7N3.2C4H6N2O.C3H5N3O.C3H5N3S/c1-6-7-4-5-11-9(7)3-2-8(6)10;1-7-2-3-9-8(6-7)4-5-10-9;1-7-3-2-4-9-8(7)5-6-10-9;1-6-2-4-9-8-7(6)3-5-10-8;1-6-4-7-2-3-9-8(7)5-10-6;1-6-4-8-7(10-5-6)2-3-9-8;1-6-4-7-2-3-9-8(7)10-5-6;1-6-2-3-8-7(4-6)5-9-10-8;1-6-2-3-7-8(10-6)4-5-9-7;1-6-3-2-4-8-7(6)5-9-10-8;1-5-2-8-4-7-6(5)3-9-10-7;1-5-2-6-4-9-10-7(6)8-3-5;1-5-6-4-9-10-7(6)2-3-8-5;1-5-2-3-8-7-6(5)4-9-10-7;4*1-3-4(2)8-5(6)7-3;1-4-2-5(6)7-3-4;1-4-2-3-7-5(4)6;1-4-2-3-5(6)7-4;1-3-2-6-4(5)7-3;1-3-2-6-7-4(3)5;1-3-2-4(5)7-6-3;1-3-2-7-4(5)6-3;1-3-2-6-4(5)7-3;1-2-5-3(4)7-6-2;1-2-5-6-3(4)7-2/h2-5,11H,1H3;2*2-6,10H,1H3;2-5H,1H3,(H,9,10);2*2-5,9H,1H3;2*2-5H,1H3,(H,9,10);2-5,9H,1H3;2-5H,1H3,(H,9,10);2-4H,1H3,(H,9,10);2-4H,1H3,(H,8,9,10);2-4H,1H3,(H,9,10);2-4H,1H3,(H,8,9,10);1-2H3,(H3,6,7,8);3*1-2H3,(H2,6,7);3*2-3H,6H2,1H3;3*2H,1H3,(H3,5,6,7);2*2H,1H3,(H2,5,6);1H3,(H2,4,5,6);1H3,(H2,4,6)
InChIKeyHKDSLHMUQINNBR-UHFFFAOYSA-N
XLogP36.77
TPSA1075.12 Ų
H-Bond Donors32
H-Bond Acceptors52
Rotatable Bonds
Heavy Atoms243
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003374.30
LogP ≤ 536.77
H-Bond Donors ≤ 532
H-Bond Acceptors ≤ 1052

Analyze 4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine with MolForge

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Launch Full Analysis

Related Compounds

5-methyl-1H-imidazole;4-methylisoquinoline;5-methylisoquinoline;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);4-methylquinoline;4-methyl-1,3-thiazole;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole
CID 157174574
3,5-dimethylpyridin-2-amine;4,5-dimethylpyridin-2-amine;N,5-dimethylpyridin-2-amine;4,5-dimethyl-1,3-thiazol-2-amine;N,5-dimethyl-1,3-thiazol-2-amine;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;5-methyl-1H-pyrazol-3-amine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;N-(5-methyl-2-pyridinyl)acetamide;2-methylpyrimidin-5-amine;5-methylpyrimidin-2-amine;4-methyl-1H-pyrrolo[2,3-b]pyridine;6-methyl-1H-pyrrolo[2,3-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;4-methyl-1,3-thiazol-2-amine;5-methyl-1,3-thiazol-2-amine;N,N,5-trimethyl-1,3-thiazol-2-amine
CID 157196924
bis(2,6-dimethyl-1H-benzimidazole);bis(2,7-dimethyl-3H-benzo[e]benzimidazole);2,7-dimethyl-4,5-dihydro-3H-benzo[e]benzimidazole;bis(2,5-dimethyl-3H-imidazo[4,5-b]pyrazine);bis(2,5-dimethyl-1H-imidazo[4,5-b]pyridine);bis(2,6-dimethyl-1H-imidazo[4,5-b]pyridine);bis(2,6-dimethyl-3H-imidazo[4,5-c]pyridine);tris(2,5-dimethyl-1H-imidazole);bis(2,5-dimethyl-1,3-oxazole);bis(2,8-dimethyl-7H-purine);bis(3,5-dimethyl-2H-pyrrole);bis(2,5-dimethyl-1,3-thiazole);bis(3,5-dimethyl-1H-1,2,4-triazole);2-methyl-1H-imidazole
CID 157379391
1H-benzimidazole;3,10-diazahexacyclo[15.8.0.02,10.04,9.011,16.018,23]pentacosa-1(17),2,4,6,8,11,13,15,18,20,22,24-dodecaene;3,10-diazahexacyclo[15.8.0.02,10.04,9.011,16.020,25]pentacosa-1(17),2,4,6,8,11,13,15,18,20,22,24-dodecaene;1H-imidazole;isoquinoline;1,3-oxazole;phenanthridine;1,10-phenanthroline;pyrazine;pyridine;pyrimidine;quinazoline;1,3-thiazole;6,14,21-triazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaene;1,3,5-triazine;1H-1,2,4-triazole
CID 157564355
tert-butylbenzene;4-tert-butyl-1-benzothiophene;2-tert-butylfuran;3-tert-butylfuran;3-tert-butyl-2H-indazole;4-tert-butyl-1H-indole;5-tert-butyl-1H-indole;2-tert-butyl-1,3-oxazole;5-tert-butyl-1,3-oxazole;3-tert-butyl-1-oxidopyridin-1-ium;2-tert-butylpyrazine;4-tert-butyl-1H-pyrazolo[5,4-c]pyridine;3-tert-butylpyridazine;4-tert-butylpyridazine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;2-tert-butyl-3H-pyrrole;4-tert-butyl-3H-pyrrole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,3-thiazole;5-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butylthiophene;methane
CID 157692213
3-methylcinnoline;1-methylimidazole;2-methyl-1H-imidazole;3-methyl-2H-indazole;2-methyl-1,8-naphthyridine;1-methylphthalazine;2-methylpteridine;8-methyl-7H-purine;2-methylpyrazine;3-methylpyridazine;2-methylpyrimidine;2-methylquinazoline;2-methylquinoxaline;1,2,5-oxadiazole;1,2-oxazole;1,3-oxazole;1,2-thiazole;1,3-thiazole
CID 157863458
3,5-dimethylpyridin-2-amine;4,5-dimethylpyridin-2-amine;N,5-dimethylpyridin-2-amine;4,5-dimethyl-1,3-thiazol-2-amine;N,5-dimethyl-1,3-thiazol-2-amine;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;N-(5-methyl-2-pyridinyl)acetamide;2-methylpyrimidin-5-amine;5-methylpyrimidin-2-amine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[2,3-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;4-methyl-1,3-thiazol-2-amine;5-methyl-1,3-thiazol-2-amine;N,N,5-trimethyl-1,3-thiazol-2-amine
CID 157889030
2-methyl-1H-imidazole;2-methyl-1,3,4-oxadiazole;3-methyl-1,2,4-oxadiazole;5-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;2-methylquinazoline;2-methylquinoline;3-methylquinoline;2-methylquinoxaline;2-methyl-1,3,4-thiadiazole;3-methyl-1,2,4-thiadiazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole
CID 158024204
6-propan-2-ylimidazo[1,2-a]pyridine;1-propan-2-ylimidazole;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);bis(4-propan-2-yl-1,3-oxazole);bis(5-propan-2-yl-1,3-oxazole);3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;1-propan-2-yltetrazole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole
CID 158500783
2-methyl-1H-imidazole;3-methylisoquinoline;2-methyl-1,3,4-oxadiazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;2-methylquinazoline;2-methylquinoline;3-methylquinoline;2-methylquinoxaline;2-methyl-1,3,4-thiadiazole;3-methyl-1,2,4-thiadiazole;2-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole
CID 158522244
tert-butylbenzene;2-tert-butylpyrazine;2-tert-butyl-1,3,4-thiadiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;octakis(2,2-dimethylpropane);1H-imidazole;1,3-oxazole;bis(1H-pyrazolo[3,4-d]pyrimidine);pyridine;2H-pyrrole;1,3-thiazole;[1,3]thiazolo[5,4-b]pyridine
CID 158844995
7-butan-2-yl-1,3-benzothiazole;4-butan-2-yl-N,N-dimethyl-3H-indol-2-amine;2-butan-2-yl-1H-imidazole;5-butan-2-yl-1H-imidazole;4-butan-2-yl-1H-indole;4-butan-2-yl-3H-indole;4-butan-2-ylisoquinoline;5-butan-2-ylisoquinoline;4-butan-2-yl-1-methylpiperidine;3-butan-2-yl-1-methylpyrrolidine;2-butan-2-yl-1,3-oxazole;5-butan-2-yl-1,3-oxazole;2-butan-2-ylpyrazine;5-butan-2-yl-1H-pyrazole;4-butan-2-ylpyridazine;3-butan-2-ylpyridine;4-butan-2-ylpyridine;4-butan-2-ylpyrimidine;2-butan-2-yl-1H-pyrrole;3-butan-2-yl-1H-pyrrole;4-butan-2-ylquinoline;5-butan-2-ylquinoline;3-ethyl-1,4-dimethylpyrrolidine;1-methyl-4-(2-methylbutyl)piperazine
CID 158908693

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine?
The IUPAC name of 4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine (CID 158503241) is 4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine.
What is the SMILES notation for 4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine?
The canonical SMILES for 4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine is Cc1c(F)ccc2[nH]ccc12.Cc1cc(N)n[nH]1.Cc1cc2cc[nH]c2cn1.Cc1ccc(N)s1.Cc1ccc2[nH]ccc2c1.Cc1ccc2[nH]ccc2n1.Cc1ccc2[nH]ncc2c1.Cc1cccc2[nH]ccc12.Cc1cccc2[nH]ncc12.Cc1ccnc2[nH]ccc12.Cc1ccnc2[nH]ncc12.Cc1ccsc1N.Cc1cn[nH]c1N.Cc1cnc(N)[nH]1.Cc1cnc(N)o1.Cc1cnc2[nH]ccc2c1.Cc1cnc2[nH]ncc2c1.Cc1cnc2cc[nH]c2c1.Cc1cncc2[nH]ncc12.Cc1coc(N)n1.Cc1csc(N)c1.Cc1nc(N)[nH]c1C.Cc1nc(N)oc1C.Cc1nc(N)oc1C.Cc1nc(N)sc1C.Cc1nccc2[nH]ncc12.Cc1nnc(N)s1.Cc1noc(N)n1.
What is the InChIKey of 4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine?
The InChIKey is HKDSLHMUQINNBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FN.2C9H9N.7C8H8N2.4C7H7N3.C5H9N3.2C5H8N2O.C5H8N2S.3C5H7NS.3C4H7N3.2C4H6N2O.C3H5N3O.C3H5N3S/c1-6-7-4-5-11-9(7)3-2-8(6)10;1-7-2-3-9-8(6-7)4-5-10-9;1-7-3-2-4-9-8(7)5-6-10-9;1-6-2-4-9-8-7(6)3-5-10-8;1-6-4-7-2-3-9-8(7)5-10-6;1-6-4-8-7(10-5-6)2-3-9-8;1-6-4-7-2-3-9-8(7)10-5-6;1-6-2-3-8-7(4-6)5-9-10-8;1-6-2-3-7-8(10-6)4-5-9-7;1-6-3-2-4-8-7(6)5-9-10-8;1-5-2-8-4-7-6(5)3-9-10-7;1-5-2-6-4-9-10-7(6)8-3-5;1-5-6-4-9-10-7(6)2-3-8-5;1-5-2-3-8-7-6(5)4-9-10-7;4*1-3-4(2)8-5(6)7-3;1-4-2-5(6)7-3-4;1-4-2-3-7-5(4)6;1-4-2-3-5(6)7-4;1-3-2-6-4(5)7-3;1-3-2-6-7-4(3)5;1-3-2-4(5)7-6-3;1-3-2-7-4(5)6-3;1-3-2-6-4(5)7-3;1-2-5-3(4)7-6-2;1-2-5-6-3(4)7-2/h2-5,11H,1H3;2*2-6,10H,1H3;2-5H,1H3,(H,9,10);2*2-5,9H,1H3;2*2-5H,1H3,(H,9,10);2-5,9H,1H3;2-5H,1H3,(H,9,10);2-4H,1H3,(H,9,10);2-4H,1H3,(H,8,9,10);2-4H,1H3,(H,9,10);2-4H,1H3,(H,8,9,10);1-2H3,(H3,6,7,8);3*1-2H3,(H2,6,7);3*2-3H,6H2,1H3;3*2H,1H3,(H3,5,6,7);2*2H,1H3,(H2,5,6);1H3,(H2,4,5,6);1H3,(H2,4,6).
What are the key properties of 4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine?
4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine has a molecular weight of 3374.30 g/mol, XLogP of 36.77, 0 rotatable bonds, 32 hydrogen bond donors, and 52 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-1H-imidazol-2-amine;bis(4,5-dimethyl-1,3-oxazol-2-amine);4,5-dimethyl-1,3-thiazol-2-amine;5-fluoro-4-methyl-1H-indole;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;4-methyl-1H-indole;5-methyl-1H-indole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;4-methyl-1H-pyrazol-5-amine;5-methyl-1H-pyrazol-3-amine;4-methyl-1H-pyrazolo[3,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methyl-1H-pyrazolo[4,5-c]pyridine;4-methyl-1H-pyrazolo[5,4-c]pyridine;4-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-1,3,4-thiadiazol-2-amine;3-methylthiophen-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine is sourced from PubChem (CID 158503241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).