N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide

C150H192F3N45O18S2 — CID 158166013

IUPACN-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide
SMILESCC(C)C(=O)Nc1ccc(F)cn1.CC(C)C(=O)Nc1cccc2cnccc12.CC(C)C(=O)Nc1ccccn1.CC(C)C(=O)Nc1cccnc1.CC(C)C(=O)Nc1cccnn1.CC(C)C(=O)Nc1ccnnc1.CC(C)C(=O)Nc1cnc2c(c1)OCCO2.CC(C)C(=O)Nc1cncc(F)c1.CC(C)C(=O)Nc1cnncn1.CC(C)C(=O)Nc1nc2ccc(F)cc2s1.CC(C)C(=O)Nc1ncnc2n[nH]nc12.CC(C)C(=O)Nc1ncnc2nc[nH]c12.Cc1ccc(NC(=O)C(C)C)cn1.Cc1ccnc(NC(=O)C(C)C)c1.Cc1cncc(NC(=O)C(C)C)c1.Cc1csc2nc(NC(=O)C(C)C)nn12
InChIInChI=1S/C13H14N2O.C11H11FN2OS.C11H14N2O3.3C10H14N2O.2C9H11FN2O.C9H11N5O.C9H12N4OS.2C9H12N2O.C8H10N6O.2C8H11N3O.C7H10N4O/c1-9(2)13(16)15-12-5-3-4-10-8-14-7-6-11(10)12;1-6(2)10(15)14-11-13-8-4-3-7(12)5-9(8)16-11;1-7(2)10(14)13-8-5-9-11(12-6-8)16-4-3-15-9;1-7(2)10(13)12-9-4-8(3)5-11-6-9;1-7(2)10(13)12-9-5-4-8(3)11-6-9;1-7(2)10(13)12-9-6-8(3)4-5-11-9;1-6(2)9(13)12-8-3-7(10)4-11-5-8;1-6(2)9(13)12-8-4-3-7(10)5-11-8;1-5(2)9(15)14-8-6-7(11-3-10-6)12-4-13-8;1-5(2)7(14)10-8-11-9-13(12-8)6(3)4-15-9;1-7(2)9(12)11-8-4-3-5-10-6-8;1-7(2)9(12)11-8-5-3-4-6-10-8;1-4(2)8(15)11-6-5-7(10-3-9-6)13-14-12-5;1-6(2)8(12)11-7-3-4-9-10-5-7;1-6(2)8(12)10-7-4-3-5-9-11-7;1-5(2)7(12)11-6-3-9-10-4-8-6/h3-9H,1-2H3,(H,15,16);3-6H,1-2H3,(H,13,14,15);5-7H,3-4H2,1-2H3,(H,13,14);2*4-7H,1-3H3,(H,12,13);4-7H,1-3H3,(H,11,12,13);3-6H,1-2H3,(H,12,13);3-6H,1-2H3,(H,11,12,13);3-5H,1-2H3,(H2,10,11,12,13,14,15);4-5H,1-3H3,(H,10,12,14);3-7H,1-2H3,(H,11,12);3-7H,1-2H3,(H,10,11,12);3-4H,1-2H3,(H2,9,10,11,12,13,14,15);3-6H,1-2H3,(H,9,11,12);3-6H,1-2H3,(H,10,11,12);3-5H,1-2H3,(H,8,10,11,12)
InChIKeyFWVSSGNKAZOJAB-UHFFFAOYSA-N
MW3034.61 g/mol
LogP25.83
Rot. Bonds32

About N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide

N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide (PubChem CID 158166013) has the molecular formula C150H192F3N45O18S2 and a molecular weight of 3034.61 g/mol. Its IUPAC name is N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide.

Molecular Properties

Compound NameN-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide
PubChem CID158166013
Molecular FormulaC150H192F3N45O18S2
Molecular Weight3034.61 g/mol
Exact Mass3032.49
IUPAC NameN-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide
SMILESCC(C)C(=O)Nc1ccc(F)cn1.CC(C)C(=O)Nc1cccc2cnccc12.CC(C)C(=O)Nc1ccccn1.CC(C)C(=O)Nc1cccnc1.CC(C)C(=O)Nc1cccnn1.CC(C)C(=O)Nc1ccnnc1.CC(C)C(=O)Nc1cnc2c(c1)OCCO2.CC(C)C(=O)Nc1cncc(F)c1.CC(C)C(=O)Nc1cnncn1.CC(C)C(=O)Nc1nc2ccc(F)cc2s1.CC(C)C(=O)Nc1ncnc2n[nH]nc12.CC(C)C(=O)Nc1ncnc2nc[nH]c12.Cc1ccc(NC(=O)C(C)C)cn1.Cc1ccnc(NC(=O)C(C)C)c1.Cc1cncc(NC(=O)C(C)C)c1.Cc1csc2nc(NC(=O)C(C)C)nn12
InChIInChI=1S/C13H14N2O.C11H11FN2OS.C11H14N2O3.3C10H14N2O.2C9H11FN2O.C9H11N5O.C9H12N4OS.2C9H12N2O.C8H10N6O.2C8H11N3O.C7H10N4O/c1-9(2)13(16)15-12-5-3-4-10-8-14-7-6-11(10)12;1-6(2)10(15)14-11-13-8-4-3-7(12)5-9(8)16-11;1-7(2)10(14)13-8-5-9-11(12-6-8)16-4-3-15-9;1-7(2)10(13)12-9-4-8(3)5-11-6-9;1-7(2)10(13)12-9-5-4-8(3)11-6-9;1-7(2)10(13)12-9-6-8(3)4-5-11-9;1-6(2)9(13)12-8-3-7(10)4-11-5-8;1-6(2)9(13)12-8-4-3-7(10)5-11-8;1-5(2)9(15)14-8-6-7(11-3-10-6)12-4-13-8;1-5(2)7(14)10-8-11-9-13(12-8)6(3)4-15-9;1-7(2)9(12)11-8-4-3-5-10-6-8;1-7(2)9(12)11-8-5-3-4-6-10-8;1-4(2)8(15)11-6-5-7(10-3-9-6)13-14-12-5;1-6(2)8(12)11-7-3-4-9-10-5-7;1-6(2)8(12)10-7-4-3-5-9-11-7;1-5(2)7(12)11-6-3-9-10-4-8-6/h3-9H,1-2H3,(H,15,16);3-6H,1-2H3,(H,13,14,15);5-7H,3-4H2,1-2H3,(H,13,14);2*4-7H,1-3H3,(H,12,13);4-7H,1-3H3,(H,11,12,13);3-6H,1-2H3,(H,12,13);3-6H,1-2H3,(H,11,12,13);3-5H,1-2H3,(H2,10,11,12,13,14,15);4-5H,1-3H3,(H,10,12,14);3-7H,1-2H3,(H,11,12);3-7H,1-2H3,(H,10,11,12);3-4H,1-2H3,(H2,9,10,11,12,13,14,15);3-6H,1-2H3,(H,9,11,12);3-6H,1-2H3,(H,10,11,12);3-5H,1-2H3,(H,8,10,11,12)
InChIKeyFWVSSGNKAZOJAB-UHFFFAOYSA-N
XLogP25.83
TPSA855.19 Ų
H-Bond Donors18
H-Bond Acceptors47
Rotatable Bonds32
Heavy Atoms218
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003034.61
LogP ≤ 525.83
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1047

Analyze N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide with MolForge

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Related Compounds

CID 157901487
CID 157901487
2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide
CID 159332933
2,2-difluoro-N-[4-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[4-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[(7-phenylimidazo[4,5-d]triazin-6-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[(7-phenylimidazo[4,5-d]triazin-6-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[4-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[4-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[(5-phenyltetrazolo[1,5-a]pyridin-6-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[(5-phenyltetrazolo[1,5-a]pyridin-6-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide
CID 160415314
2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide
CID 161441171
CID 157970281
CID 157970281
6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-1,3-benzothiazole;7-propan-2-yl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-propan-2-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one;6-propan-2-yl-3H-[1,3]oxazolo[4,5-b]pyridin-2-one;5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-ylpyridine;7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;6-propan-2-ylquinoxaline
CID 158484203
CID 158529219
CID 158529219
CID 158583917
CID 158583917
N-[[6-(3,5-difluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-7-[[(2R)-pyrrolidin-2-yl]methoxy]-1,5-naphthyridin-4-amine;N-[[6-(3,5-difluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-7-[[(2S)-pyrrolidin-2-yl]methoxy]-1,5-naphthyridin-4-amine;7-methoxy-N-[[6-(2-morpholin-4-yl-1,3-thiazol-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-1,5-naphthyridin-4-amine;N-[[6-(3-methyl-1,2-thiazol-5-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-1H-imidazo[4,5-b]pyridin-7-amine;N-[[6-(3,4,5-trifluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-3H-pyrrolo[3,2-b]pyridin-7-amine
CID 158941466
cumene;2-propan-2-yl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole;2-propan-2-yl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;5-propan-2-yl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridine;1-propan-2-ylimidazole;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;1-propan-2-ylpiperidine;2-propan-2-ylpyrazine;bis(1-propan-2-ylpyrazole);tris(2-propan-2-ylpyridine);bis(4-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;bis(5-propan-2-yl-3H-pyrrole);1-propan-2-ylpyrrolidine;2-propan-2-ylquinoline;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2-thiazole;1-propan-2-yl-1,2,4-triazole
CID 160301626
N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;bis(2-methyl-N-(6-methyl-3-pyridinyl)propanamide);2-methyl-N-(4-methylpyrimidin-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-pyrimidin-2-ylpropanamide;2-methyl-N-pyrimidin-4-ylpropanamide;2-methyl-N-pyrimidin-5-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide
CID 160446653
CID 160801506
CID 160801506

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide?
The IUPAC name of N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide (CID 158166013) is N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide.
What is the SMILES notation for N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide?
The canonical SMILES for N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide is CC(C)C(=O)Nc1ccc(F)cn1.CC(C)C(=O)Nc1cccc2cnccc12.CC(C)C(=O)Nc1ccccn1.CC(C)C(=O)Nc1cccnc1.CC(C)C(=O)Nc1cccnn1.CC(C)C(=O)Nc1ccnnc1.CC(C)C(=O)Nc1cnc2c(c1)OCCO2.CC(C)C(=O)Nc1cncc(F)c1.CC(C)C(=O)Nc1cnncn1.CC(C)C(=O)Nc1nc2ccc(F)cc2s1.CC(C)C(=O)Nc1ncnc2n[nH]nc12.CC(C)C(=O)Nc1ncnc2nc[nH]c12.Cc1ccc(NC(=O)C(C)C)cn1.Cc1ccnc(NC(=O)C(C)C)c1.Cc1cncc(NC(=O)C(C)C)c1.Cc1csc2nc(NC(=O)C(C)C)nn12.
What is the InChIKey of N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide?
The InChIKey is FWVSSGNKAZOJAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O.C11H11FN2OS.C11H14N2O3.3C10H14N2O.2C9H11FN2O.C9H11N5O.C9H12N4OS.2C9H12N2O.C8H10N6O.2C8H11N3O.C7H10N4O/c1-9(2)13(16)15-12-5-3-4-10-8-14-7-6-11(10)12;1-6(2)10(15)14-11-13-8-4-3-7(12)5-9(8)16-11;1-7(2)10(14)13-8-5-9-11(12-6-8)16-4-3-15-9;1-7(2)10(13)12-9-4-8(3)5-11-6-9;1-7(2)10(13)12-9-5-4-8(3)11-6-9;1-7(2)10(13)12-9-6-8(3)4-5-11-9;1-6(2)9(13)12-8-3-7(10)4-11-5-8;1-6(2)9(13)12-8-4-3-7(10)5-11-8;1-5(2)9(15)14-8-6-7(11-3-10-6)12-4-13-8;1-5(2)7(14)10-8-11-9-13(12-8)6(3)4-15-9;1-7(2)9(12)11-8-4-3-5-10-6-8;1-7(2)9(12)11-8-5-3-4-6-10-8;1-4(2)8(15)11-6-5-7(10-3-9-6)13-14-12-5;1-6(2)8(12)11-7-3-4-9-10-5-7;1-6(2)8(12)10-7-4-3-5-9-11-7;1-5(2)7(12)11-6-3-9-10-4-8-6/h3-9H,1-2H3,(H,15,16);3-6H,1-2H3,(H,13,14,15);5-7H,3-4H2,1-2H3,(H,13,14);2*4-7H,1-3H3,(H,12,13);4-7H,1-3H3,(H,11,12,13);3-6H,1-2H3,(H,12,13);3-6H,1-2H3,(H,11,12,13);3-5H,1-2H3,(H2,10,11,12,13,14,15);4-5H,1-3H3,(H,10,12,14);3-7H,1-2H3,(H,11,12);3-7H,1-2H3,(H,10,11,12);3-4H,1-2H3,(H2,9,10,11,12,13,14,15);3-6H,1-2H3,(H,9,11,12);3-6H,1-2H3,(H,10,11,12);3-5H,1-2H3,(H,8,10,11,12).
What are the key properties of N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide?
N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide has a molecular weight of 3034.61 g/mol, XLogP of 25.83, 32 rotatable bonds, 18 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide is sourced from PubChem (CID 158166013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).