N-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide

C109H111N41O7 — CID 158152827

IUPACN-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide
SMILESC=C(CC)Nc1cccc(COc2nc3ccccc3n2-c2nnnn2C)n1.C=C(Nc1cccc(COc2nc3ccccc3n2-c2nnnn2C)n1)C(CC)CC.C=C(Nc1cccc(COc2nc3ccccc3n2-c2nnnn2C)n1)C1CCCCC1.C=C(Nc1cccc(COc2nc3ccccc3n2-c2nnnn2C)n1)c1ccc(OC)cc1.Cn1nnnc1-n1c(OCc2cccc(NC(=O)c3ccccn3)n2)nc2ccccc21
InChIInChI=1S/C24H22N8O2.C23H26N8O.C22H26N8O.C21H17N9O2.C19H20N8O/c1-16(17-11-13-19(33-3)14-12-17)25-22-10-6-7-18(26-22)15-34-24-27-20-8-4-5-9-21(20)32(24)23-28-29-30-31(23)2;1-16(17-9-4-3-5-10-17)24-21-14-8-11-18(25-21)15-32-23-26-19-12-6-7-13-20(19)31(23)22-27-28-29-30(22)2;1-5-16(6-2)15(3)23-20-13-9-10-17(24-20)14-31-22-25-18-11-7-8-12-19(18)30(22)21-26-27-28-29(21)4;1-29-20(26-27-28-29)30-17-10-3-2-8-15(17)24-21(30)32-13-14-7-6-11-18(23-14)25-19(31)16-9-4-5-12-22-16;1-4-13(2)20-17-11-7-8-14(21-17)12-28-19-22-15-9-5-6-10-16(15)27(19)18-23-24-25-26(18)3/h4-14H,1,15H2,2-3H3,(H,25,26);6-8,11-14,17H,1,3-5,9-10,15H2,2H3,(H,24,25);7-13,16H,3,5-6,14H2,1-2,4H3,(H,23,24);2-12H,13H2,1H3,(H,23,25,31);5-11H,2,4,12H2,1,3H3,(H,20,21)
InChIKeyFVIDEVKAKXNDHQ-UHFFFAOYSA-N
MW2107.37 g/mol
LogP16.56
Rot. Bonds37

About N-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide

N-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide (PubChem CID 158152827) has the molecular formula C109H111N41O7 and a molecular weight of 2107.37 g/mol. Its IUPAC name is N-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide
PubChem CID158152827
Molecular FormulaC109H111N41O7
Molecular Weight2107.37 g/mol
Exact Mass2105.96
IUPAC NameN-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide
SMILESC=C(CC)Nc1cccc(COc2nc3ccccc3n2-c2nnnn2C)n1.C=C(Nc1cccc(COc2nc3ccccc3n2-c2nnnn2C)n1)C(CC)CC.C=C(Nc1cccc(COc2nc3ccccc3n2-c2nnnn2C)n1)C1CCCCC1.C=C(Nc1cccc(COc2nc3ccccc3n2-c2nnnn2C)n1)c1ccc(OC)cc1.Cn1nnnc1-n1c(OCc2cccc(NC(=O)c3ccccn3)n2)nc2ccccc21
InChIInChI=1S/C24H22N8O2.C23H26N8O.C22H26N8O.C21H17N9O2.C19H20N8O/c1-16(17-11-13-19(33-3)14-12-17)25-22-10-6-7-18(26-22)15-34-24-27-20-8-4-5-9-21(20)32(24)23-28-29-30-31(23)2;1-16(17-9-4-3-5-10-17)24-21-14-8-11-18(25-21)15-32-23-26-19-12-6-7-13-20(19)31(23)22-27-28-29-30(22)2;1-5-16(6-2)15(3)23-20-13-9-10-17(24-20)14-31-22-25-18-11-7-8-12-19(18)30(22)21-26-27-28-29(21)4;1-29-20(26-27-28-29)30-17-10-3-2-8-15(17)24-21(30)32-13-14-7-6-11-18(23-14)25-19(31)16-9-4-5-12-22-16;1-4-13(2)20-17-11-7-8-14(21-17)12-28-19-22-15-9-5-6-10-16(15)27(19)18-23-24-25-26(18)3/h4-14H,1,15H2,2-3H3,(H,25,26);6-8,11-14,17H,1,3-5,9-10,15H2,2H3,(H,24,25);7-13,16H,3,5-6,14H2,1-2,4H3,(H,23,24);2-12H,13H2,1H3,(H,23,25,31);5-11H,2,4,12H2,1,3H3,(H,20,21)
InChIKeyFVIDEVKAKXNDHQ-UHFFFAOYSA-N
XLogP16.56
TPSA517.04 Ų
H-Bond Donors5
H-Bond Acceptors47
Rotatable Bonds37
Heavy Atoms157
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002107.37
LogP ≤ 516.56
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1047

Analyze N-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide with MolForge

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Related Compounds

2-N-[4-(difluoromethoxy)phenyl]-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)pyrimidine-2,4-diamine;2-N-[4-(difluoromethoxy)phenyl]-6-(2-ethyl-5,6-difluorobenzimidazol-1-yl)pyrimidine-2,4-diamine;2-N-[4-(difluoromethoxy)phenyl]-6-[6-fluoro-2-(methoxymethyl)benzimidazol-1-yl]pyrimidine-2,4-diamine;3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;6-[2-(methoxymethyl)benzimidazol-1-yl]-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;6-(2-propan-2-ylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
CID 158977297
1-[6-[4-(difluoromethoxy)anilino]pyrazin-2-yl]-N-methylbenzimidazol-2-amine;4-[[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]amino]benzamide;N-methyl-4-[[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]amino]benzamide;N-methyl-1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazol-2-amine;1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazole-2-carbonitrile
CID 159508021
N-[5-[5-ethoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-[5-ethoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyrazin-2-yl]-3,5-difluoropyridine-4-carboxamide;N-[5-[5-ethoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyrazin-2-yl]-2-fluorobenzamide;N-[5-[5-ethoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyrazin-2-yl]-3-fluoropyridine-4-carboxamide;N-[5-[5-ethoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyrazin-2-yl]-3-methylpyridine-4-carboxamide;5-[5-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyrazine-2-carboxamide
CID 173170209
2,6-difluoro-N-[5-[6-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyrazin-2-yl]benzamide;5-[5-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]-N-[4-[[5-[5-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyrazin-2-yl]amino]-3-methyl-4-oxobutyl]pyrazine-2-carboxamide;N-[5-[6-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyrazin-2-yl]-2-methylpyridine-3-carboxamide;N-[5-[6-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyrazin-2-yl]-3-methylpyridine-4-carboxamide;N-[5-[5-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyrazin-2-yl]propanamide
CID 173170752
N-[3-amino-1-[5-[5-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyrazin-2-yl]-3-oxopropyl]-5-[5-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]-N-[4-[[5-[5-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyrazin-2-yl]amino]-3-methyl-4-oxobutyl]pyrazine-2-carboxamide;2,6-difluoro-N-[5-[6-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyrazin-2-yl]benzamide;N-[5-[6-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyrazin-2-yl]-2-methylpyridine-3-carboxamide;N-[5-[6-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyrazin-2-yl]-3-methylpyridine-4-carboxamide
CID 173422565
[4-[4-[2-[Bis[(4-methoxyphenyl)methyl]amino]pyrimidin-5-yl]-2-morpholin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl]-2-pyridinyl]-piperazin-1-ylmethanone
CID 150804115
[4-[[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]carbamoyl]phenyl] 4-methylpiperazine-1-carboxylate;N-[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-c]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide
CID 157213977
7-Anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-ethylphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;7-(2,5-dioxopyrrolidin-1-yl)-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane
CID 157445782
2-[2-(2-aminopyrimidin-5-yl)-4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-7-yl]propan-2-ol;1-[2-(dimethylamino)ethyl]-3-[4-[4-[(3R)-3-methylmorpholin-4-yl]pyrrolo[2,1-f][1,2,4]triazin-2-yl]phenyl]urea;[2-methoxy-5-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]methanol;N-methyl-3-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)benzamide;2-[4-(4-morpholin-4-ylpyrrolo[2,1-f][1,2,4]triazin-2-yl)phenyl]-1-phenylguanidine
CID 157480521
N-cyclohexyl-4-[[8-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[8-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(1-methylpiperidin-4-yl)benzamide;4-[[8-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-morpholin-4-ylethyl)benzamide;4-[[8-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-piperidin-4-ylbenzamide;4-[[8-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(piperidin-4-ylmethyl)benzamide
CID 157502750
7-Anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane
CID 157510315
4-(8-amino-2-piperidin-4-ylimidazo[1,2-a]pyrazin-5-yl)-N-[(4-methoxyphenyl)methyl]benzamide;2-methyl-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;5-(1-methylpyrazol-4-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(1-methylpyrazol-4-yl)-2-piperidin-4-ylimidazo[1,2-a]pyrazin-8-amine;5-(1-methylpyrazol-4-yl)-2-pyrrolidin-3-ylimidazo[1,2-a]pyrazin-8-amine;2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;2-piperidin-4-ylimidazo[1,2-a]pyrazin-8-amine;2-pyrrolidin-3-ylimidazo[1,2-a]pyrazin-8-amine
CID 157604593

Frequently Asked Questions

What is the IUPAC name of N-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide?
The IUPAC name of N-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide (CID 158152827) is N-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide.
What is the SMILES notation for N-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide?
The canonical SMILES for N-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide is C=C(CC)Nc1cccc(COc2nc3ccccc3n2-c2nnnn2C)n1.C=C(Nc1cccc(COc2nc3ccccc3n2-c2nnnn2C)n1)C(CC)CC.C=C(Nc1cccc(COc2nc3ccccc3n2-c2nnnn2C)n1)C1CCCCC1.C=C(Nc1cccc(COc2nc3ccccc3n2-c2nnnn2C)n1)c1ccc(OC)cc1.Cn1nnnc1-n1c(OCc2cccc(NC(=O)c3ccccn3)n2)nc2ccccc21.
What is the InChIKey of N-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide?
The InChIKey is FVIDEVKAKXNDHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N8O2.C23H26N8O.C22H26N8O.C21H17N9O2.C19H20N8O/c1-16(17-11-13-19(33-3)14-12-17)25-22-10-6-7-18(26-22)15-34-24-27-20-8-4-5-9-21(20)32(24)23-28-29-30-31(23)2;1-16(17-9-4-3-5-10-17)24-21-14-8-11-18(25-21)15-32-23-26-19-12-6-7-13-20(19)31(23)22-27-28-29-30(22)2;1-5-16(6-2)15(3)23-20-13-9-10-17(24-20)14-31-22-25-18-11-7-8-12-19(18)30(22)21-26-27-28-29(21)4;1-29-20(26-27-28-29)30-17-10-3-2-8-15(17)24-21(30)32-13-14-7-6-11-18(23-14)25-19(31)16-9-4-5-12-22-16;1-4-13(2)20-17-11-7-8-14(21-17)12-28-19-22-15-9-5-6-10-16(15)27(19)18-23-24-25-26(18)3/h4-14H,1,15H2,2-3H3,(H,25,26);6-8,11-14,17H,1,3-5,9-10,15H2,2H3,(H,24,25);7-13,16H,3,5-6,14H2,1-2,4H3,(H,23,24);2-12H,13H2,1H3,(H,23,25,31);5-11H,2,4,12H2,1,3H3,(H,20,21).
What are the key properties of N-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide?
N-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide has a molecular weight of 2107.37 g/mol, XLogP of 16.56, 37 rotatable bonds, 5 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for N-but-1-en-2-yl-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(1-cyclohexylethenyl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-(3-ethylpent-1-en-2-yl)-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[1-(4-methoxyphenyl)ethenyl]-6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]pyridin-2-amine;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]pyridine-2-carboxamide is sourced from PubChem (CID 158152827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).