N,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide

C201H202N26O11S7 — CID 157289274

IUPACN,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide
SMILESCC(=O)Nc1cccc(C)c1.CNC(=O)c1cccc(C)c1.Cc1c[nH]c2ccccc12.Cc1cc2cc(O)ccc2[nH]1.Cc1cc2cc(O)ccc2o1.Cc1cc2cc(O)ccc2s1.Cc1cc2ccccc2[nH]1.Cc1cc2ccccc2o1.Cc1cc2ccccc2s1.Cc1ccc2[nH]c(N)cc2c1.Cc1ccc2c(c1)cc(N)n2C.Cc1ccc2c(c1)nc(N)n2C.Cc1ccc2nc(N)[nH]c2c1.Cc1ccc2oc(N)cc2c1.Cc1ccc2oc(N)nc2c1.Cc1ccc2sc(N)cc2c1.Cc1ccc2sc(N)nc2c1.Cc1coc2ccccc12.Cc1csc2ccccc12.Cc1nc2ccccc2[nH]1.Cc1nc2ccccc2o1.Cc1nc2ccccc2s1.Cc1nsc2ccccc12
InChIInChI=1S/C10H12N2.C9H11N3.C9H10N2.2C9H9NO.2C9H11NO.C9H9NS.2C9H9N.C9H8O2.C9H8OS.2C9H8O.2C9H8S.C8H9N3.C8H8N2O.C8H8N2S.C8H8N2.C8H7NO.2C8H7NS/c1-7-3-4-9-8(5-7)6-10(11)12(9)2;1-6-3-4-8-7(5-6)11-9(10)12(8)2;1-6-2-3-8-7(4-6)5-9(10)11-8;1-6-4-7-5-8(11)2-3-9(7)10-6;1-6-2-3-8-7(4-6)5-9(10)11-8;1-7-4-3-5-8(6-7)9(11)10-2;1-7-4-3-5-9(6-7)10-8(2)11;1-6-2-3-8-7(4-6)5-9(10)11-8;1-7-6-10-9-5-3-2-4-8(7)9;1-7-6-8-4-2-3-5-9(8)10-7;2*1-6-4-7-5-8(10)2-3-9(7)11-6;1-7-6-10-9-5-3-2-4-8(7)9;1-7-6-8-4-2-3-5-9(8)10-7;1-7-6-10-9-5-3-2-4-8(7)9;1-7-6-8-4-2-3-5-9(8)10-7;1-5-2-3-6-7(4-5)11-8(9)10-6;2*1-5-2-3-7-6(4-5)10-8(9)11-7;3*1-6-9-7-4-2-3-5-8(7)10-6;1-6-7-4-2-3-5-8(7)10-9-6/h3-6H,11H2,1-2H3;3-5H,1-2H3,(H2,10,11);2-5,11H,10H2,1H3;2-5,10-11H,1H3;2-5H,10H2,1H3;2*3-6H,1-2H3,(H,10,11);2-5H,10H2,1H3;2*2-6,10H,1H3;2*2-5,10H,1H3;4*2-6H,1H3;2-4H,1H3,(H3,9,10,11);2*2-4H,1H3,(H2,9,10);2-5H,1H3,(H,9,10);3*2-5H,1H3
InChIKeyBAPMYWZQAGHKCB-UHFFFAOYSA-N
MW3382.47 g/mol
LogP52.99
Rot. Bonds2

About N,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide

N,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide (PubChem CID 157289274) has the molecular formula C201H202N26O11S7 and a molecular weight of 3382.47 g/mol. Its IUPAC name is N,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide
PubChem CID157289274
Molecular FormulaC201H202N26O11S7
Molecular Weight3382.47 g/mol
Exact Mass3379.41
IUPAC NameN,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide
SMILESCC(=O)Nc1cccc(C)c1.CNC(=O)c1cccc(C)c1.Cc1c[nH]c2ccccc12.Cc1cc2cc(O)ccc2[nH]1.Cc1cc2cc(O)ccc2o1.Cc1cc2cc(O)ccc2s1.Cc1cc2ccccc2[nH]1.Cc1cc2ccccc2o1.Cc1cc2ccccc2s1.Cc1ccc2[nH]c(N)cc2c1.Cc1ccc2c(c1)cc(N)n2C.Cc1ccc2c(c1)nc(N)n2C.Cc1ccc2nc(N)[nH]c2c1.Cc1ccc2oc(N)cc2c1.Cc1ccc2oc(N)nc2c1.Cc1ccc2sc(N)cc2c1.Cc1ccc2sc(N)nc2c1.Cc1coc2ccccc12.Cc1csc2ccccc12.Cc1nc2ccccc2[nH]1.Cc1nc2ccccc2o1.Cc1nc2ccccc2s1.Cc1nsc2ccccc12
InChIInChI=1S/C10H12N2.C9H11N3.C9H10N2.2C9H9NO.2C9H11NO.C9H9NS.2C9H9N.C9H8O2.C9H8OS.2C9H8O.2C9H8S.C8H9N3.C8H8N2O.C8H8N2S.C8H8N2.C8H7NO.2C8H7NS/c1-7-3-4-9-8(5-7)6-10(11)12(9)2;1-6-3-4-8-7(5-6)11-9(10)12(8)2;1-6-2-3-8-7(4-6)5-9(10)11-8;1-6-4-7-5-8(11)2-3-9(7)10-6;1-6-2-3-8-7(4-6)5-9(10)11-8;1-7-4-3-5-8(6-7)9(11)10-2;1-7-4-3-5-9(6-7)10-8(2)11;1-6-2-3-8-7(4-6)5-9(10)11-8;1-7-6-10-9-5-3-2-4-8(7)9;1-7-6-8-4-2-3-5-9(8)10-7;2*1-6-4-7-5-8(10)2-3-9(7)11-6;1-7-6-10-9-5-3-2-4-8(7)9;1-7-6-8-4-2-3-5-9(8)10-7;1-7-6-10-9-5-3-2-4-8(7)9;1-7-6-8-4-2-3-5-9(8)10-7;1-5-2-3-6-7(4-5)11-8(9)10-6;2*1-5-2-3-7-6(4-5)10-8(9)11-7;3*1-6-9-7-4-2-3-5-8(7)10-6;1-6-7-4-2-3-5-8(7)10-9-6/h3-6H,11H2,1-2H3;3-5H,1-2H3,(H2,10,11);2-5,11H,10H2,1H3;2-5,10-11H,1H3;2-5H,10H2,1H3;2*3-6H,1-2H3,(H,10,11);2-5H,10H2,1H3;2*2-6,10H,1H3;2*2-5,10H,1H3;4*2-6H,1H3;2-4H,1H3,(H3,9,10,11);2*2-4H,1H3,(H2,9,10);2-5H,1H3,(H,9,10);3*2-5H,1H3
InChIKeyBAPMYWZQAGHKCB-UHFFFAOYSA-N
XLogP52.99
TPSA613.61 Ų
H-Bond Donors19
H-Bond Acceptors36
Rotatable Bonds2
Heavy Atoms245
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003382.47
LogP ≤ 552.99
H-Bond Donors ≤ 519
H-Bond Acceptors ≤ 1036

Analyze N,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide with MolForge

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Launch Full Analysis

Related Compounds

N,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;1,3-dimethyl-5-(trifluoromethyl)benzene;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;3-methyl-2H-indazole;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide
CID 158727015
N,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;1,3-dimethyl-5-(trifluoromethyl)benzene;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;3-methyl-2H-indazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide
CID 164090390
2-(1H-benzimidazol-2-yl)-5-(1-benzofuran-2-yl)-4-(1,3-benzothiazol-2-yl)-7-(1H-imidazol-2-yl)-6-(1,3-oxazol-2-yl)-2-(1,3-thiazol-2-yl)-3H-1,3-benzoxazole
CID 141195189
4-(1H-benzimidazol-2-ylmethoxy)-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;4-(1-benzofuran-5-ylmethoxy)-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;4-(1,3-benzothiazol-2-ylmethoxy)-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;4-(1,3-benzoxazol-5-ylmethoxy)-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;4-(2,3-dihydro-1H-isoindol-5-ylmethoxy)-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;2-(6-methylidene-2-oxopiperidin-3-yl)-4-(quinolin-2-ylmethoxy)-3H-isoindol-1-one;2-(6-methylidene-2-oxopiperidin-3-yl)-4-(quinolin-3-ylmethoxy)-3H-isoindol-1-one;hydrochloride
CID 157099246
2-(1-benzofuran-2-carbonylamino)-4-(1,3-benzothiazol-2-yl)thiophene-3-carboxylic acid;2-(1-benzofuran-2-carbonylamino)-4-(1,3-benzothiazol-5-yl)thiophene-3-carboxylic acid;2-(1-benzofuran-2-carbonylamino)-4-(1-benzothiophen-2-yl)thiophene-3-carboxylic acid;2-(1-benzofuran-2-carbonylamino)-4-[1-(difluoromethyl)benzimidazol-2-yl]thiophene-3-carboxylic acid;2-(1-benzofuran-2-carbonylamino)-4-(1H-indol-3-yl)thiophene-3-carboxylic acid;2-(1-benzofuran-2-carbonylamino)-4-(1-methylindol-5-yl)thiophene-3-carboxylic acid;4-(1,3-benzothiazol-2-yl)-2-(1,3-benzoxazole-2-carbonylamino)thiophene-3-carboxylic acid;2-(1,3-benzoxazole-2-carbonylamino)-4-imidazo[1,2-a]pyridin-6-ylthiophene-3-carboxylic acid
CID 157365319
2-[2-(1-benzofuran-2-yl)-2-oxoethyl]-4-(1,3-benzothiazol-2-yl)thiophene-3-carboxylic acid;2-[2-(1-benzofuran-2-yl)-2-oxoethyl]-4-(1-benzothiophen-2-yl)thiophene-3-carboxylic acid;2-[2-(1-benzofuran-2-yl)-2-oxoethyl]-4-[1-(difluoromethyl)benzimidazol-2-yl]thiophene-3-carboxylic acid;2-[2-(1-benzofuran-2-yl)-2-oxoethyl]-4-(1H-indol-3-yl)thiophene-3-carboxylic acid;2-[2-(1-benzofuran-2-yl)-2-oxoethyl]-4-(1-methylindol-5-yl)thiophene-3-carboxylic acid;4-(1,3-benzothiazol-2-yl)-2-[2-(1,3-benzoxazol-2-yl)-2-oxoethyl]thiophene-3-carboxylic acid;2-[2-(1,3-benzoxazol-2-yl)-2-oxoethyl]-4-imidazo[1,2-a]pyridin-6-ylthiophene-3-carboxylic acid
CID 157433573
tert-butylbenzene;4-tert-butyl-1-benzofuran;5-tert-butyl-1-benzofuran;6-tert-butyl-1-benzofuran;7-tert-butyl-1-benzofuran;4-tert-butyl-1-benzothiophene;5-tert-butyl-1-benzothiophene;6-tert-butyl-1-benzothiophene;7-tert-butyl-1-benzothiophene;4-tert-butyl-1,3-benzoxazole;5-tert-butyl-1,3-benzoxazole;6-tert-butyl-1,3-benzoxazole;7-tert-butyl-1,3-benzoxazole;4-tert-butyl-1H-indole;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;7-tert-butyl-1H-indole;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-1-methylbenzimidazole;7-tert-butyl-1-methylbenzimidazole;4-tert-butyl-1-methylindole;5-tert-butyl-1-methylindole;6-tert-butyl-1-methylindole;7-tert-butyl-1-methylindole
CID 157601569
1,5-dimethylbenzimidazole;1,6-dimethylbenzimidazole;2,6-dimethyl-1H-benzimidazole;2,5-dimethyl-1-benzofuran;2,6-dimethyl-1-benzofuran;3,5-dimethyl-1-benzofuran;3,6-dimethyl-1-benzofuran;2,5-dimethyl-1,3-benzothiazole;2,6-dimethyl-1,3-benzothiazole;3,5-dimethyl-1,2-benzothiazole;3,6-dimethyl-1,2-benzothiazole;2,5-dimethyl-1-benzothiophene;2,6-dimethyl-1-benzothiophene;3,5-dimethyl-1-benzothiophene;3,6-dimethyl-1-benzothiophene;2,5-dimethyl-1,3-benzoxazole;2,6-dimethyl-1,3-benzoxazole;3,5-dimethyl-1,2-benzoxazole;3,6-dimethyl-1,2-benzoxazole;2,6-dimethyl-3H-indole
CID 157871906
3H-[1]benzofuro[3,2-f][1,3]benzoxazole-2-thione;1,2-dimethyl-[1]benzothiolo[3,2-f]benzimidazol-6-ol;3-ethyl-2-methyl-[1]benzothiolo[2,3-e]benzimidazole;N-(3-ethyl-2-methyl-5H-pyrrolo[3,2-f]benzimidazol-7-yl)acetamide;2-methylfuro[3,2-f][1,3]benzoxazole-6-carboxylic acid;2-methylthieno[3,2-f][1,3]benzothiazole;N,N,2,9-tetramethyl-[1,3]oxazolo[5,4-b]carbazol-6-amine;7,8,8-trimethylfuro[2,3-e]indole
CID 157900051
3H-[1]benzofuro[3,2-f][1,3]benzoxazole-2-thione;1,2-dimethyl-3H-[1]benzothiolo[2,3-f]benzimidazol-1-ium-6-ol;2-ethyl-[1]benzothiolo[3,2-f][1,3]benzoxazole;3-ethyl-2-methyl-[1]benzothiolo[2,3-e]benzimidazole;N-(3-ethyl-2-methyl-5H-pyrrolo[3,2-f]benzimidazol-7-yl)acetamide;(2-methylfuro[3,2-f][1,3]benzoxazol-6-yl)oxymethanol;2-methylsulfanyl-9H-[1,3]oxazolo[5,4-b]carbazole;N,N,2,9-tetramethyl-[1,3]oxazolo[5,4-b]carbazol-6-amine;7,8,8-trimethylfuro[2,3-e]indole
CID 157926353
2-(3H-benzimidazol-5-yl)-N-(4-piperazin-1-yl-3-pyridinyl)-1,3-oxazole-5-carboxamide;2-(1-benzofuran-5-yl)-N-(4-piperazin-1-yl-3-pyridinyl)-1,3-oxazole-5-carboxamide;2-(1,3-benzothiazol-5-yl)-N-(4-piperazin-1-yl-3-pyridinyl)-1,3-oxazole-5-carboxamide;2-(1-benzothiophen-5-yl)-N-(4-piperazin-1-yl-3-pyridinyl)-1,3-oxazole-5-carboxamide;2-(1H-indol-5-yl)-N-(4-piperazin-1-yl-3-pyridinyl)-1,3-oxazole-5-carboxamide;2-(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)-N-(4-piperazin-1-yl-3-pyridinyl)-1,3-oxazole-5-carboxamide
CID 157954444
6-tert-butyl-1-benzofuran;6-tert-butyl-1-benzothiophene;6-tert-butyl-1H-indole;6-tert-butyl-3H-indole;7-tert-butylisoquinoline;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butyl-2-methyl-1,3-benzoxazole;6-tert-butylquinoline;2,5-dimethyl-1,3-benzothiazole;1-ethyl-5-propan-2-ylbenzimidazole;methane;6-propan-2-yl-3H-indole
CID 158088482

Frequently Asked Questions

What is the IUPAC name of N,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide?
The IUPAC name of N,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide (CID 157289274) is N,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide.
What is the SMILES notation for N,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide?
The canonical SMILES for N,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide is CC(=O)Nc1cccc(C)c1.CNC(=O)c1cccc(C)c1.Cc1c[nH]c2ccccc12.Cc1cc2cc(O)ccc2[nH]1.Cc1cc2cc(O)ccc2o1.Cc1cc2cc(O)ccc2s1.Cc1cc2ccccc2[nH]1.Cc1cc2ccccc2o1.Cc1cc2ccccc2s1.Cc1ccc2[nH]c(N)cc2c1.Cc1ccc2c(c1)cc(N)n2C.Cc1ccc2c(c1)nc(N)n2C.Cc1ccc2nc(N)[nH]c2c1.Cc1ccc2oc(N)cc2c1.Cc1ccc2oc(N)nc2c1.Cc1ccc2sc(N)cc2c1.Cc1ccc2sc(N)nc2c1.Cc1coc2ccccc12.Cc1csc2ccccc12.Cc1nc2ccccc2[nH]1.Cc1nc2ccccc2o1.Cc1nc2ccccc2s1.Cc1nsc2ccccc12.
What is the InChIKey of N,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide?
The InChIKey is BAPMYWZQAGHKCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2.C9H11N3.C9H10N2.2C9H9NO.2C9H11NO.C9H9NS.2C9H9N.C9H8O2.C9H8OS.2C9H8O.2C9H8S.C8H9N3.C8H8N2O.C8H8N2S.C8H8N2.C8H7NO.2C8H7NS/c1-7-3-4-9-8(5-7)6-10(11)12(9)2;1-6-3-4-8-7(5-6)11-9(10)12(8)2;1-6-2-3-8-7(4-6)5-9(10)11-8;1-6-4-7-5-8(11)2-3-9(7)10-6;1-6-2-3-8-7(4-6)5-9(10)11-8;1-7-4-3-5-8(6-7)9(11)10-2;1-7-4-3-5-9(6-7)10-8(2)11;1-6-2-3-8-7(4-6)5-9(10)11-8;1-7-6-10-9-5-3-2-4-8(7)9;1-7-6-8-4-2-3-5-9(8)10-7;2*1-6-4-7-5-8(10)2-3-9(7)11-6;1-7-6-10-9-5-3-2-4-8(7)9;1-7-6-8-4-2-3-5-9(8)10-7;1-7-6-10-9-5-3-2-4-8(7)9;1-7-6-8-4-2-3-5-9(8)10-7;1-5-2-3-6-7(4-5)11-8(9)10-6;2*1-5-2-3-7-6(4-5)10-8(9)11-7;3*1-6-9-7-4-2-3-5-8(7)10-6;1-6-7-4-2-3-5-8(7)10-9-6/h3-6H,11H2,1-2H3;3-5H,1-2H3,(H2,10,11);2-5,11H,10H2,1H3;2-5,10-11H,1H3;2-5H,10H2,1H3;2*3-6H,1-2H3,(H,10,11);2-5H,10H2,1H3;2*2-6,10H,1H3;2*2-5,10H,1H3;4*2-6H,1H3;2-4H,1H3,(H3,9,10,11);2*2-4H,1H3,(H2,9,10);2-5H,1H3,(H,9,10);3*2-5H,1H3.
What are the key properties of N,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide?
N,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide has a molecular weight of 3382.47 g/mol, XLogP of 52.99, 2 rotatable bonds, 19 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethylbenzamide;1,5-dimethylbenzimidazol-2-amine;1,5-dimethylindol-2-amine;6-methyl-1H-benzimidazol-2-amine;2-methyl-1H-benzimidazole;2-methyl-1-benzofuran;3-methyl-1-benzofuran;5-methyl-1-benzofuran-2-amine;2-methyl-1-benzofuran-5-ol;5-methyl-1,3-benzothiazol-2-amine;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;5-methyl-1-benzothiophen-2-amine;2-methyl-1-benzothiophene;3-methyl-1-benzothiophene;2-methyl-1-benzothiophen-5-ol;5-methyl-1,3-benzoxazol-2-amine;2-methyl-1,3-benzoxazole;5-methyl-1H-indol-2-amine;2-methyl-1H-indole;3-methyl-1H-indole;2-methyl-1H-indol-5-ol;N-(3-methylphenyl)acetamide is sourced from PubChem (CID 157289274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).