5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide

C137H120N18O13S6 — CID 158962577

IUPAC5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide
SMILESCc1cccc(COc2cc(-n3cnc4ccccc43)sc2C(N)=O)c1.Cc1ccccc1COc1cc(-n2cnc3ccccc32)sc1C(=O)NC(C)C.Cc1ccccc1COc1cc(-n2cnc3ccccc32)sc1C(=O)NCCO.Cc1ccccc1COc1cc(-n2cnc3ccccc32)sc1C(=O)NCc1ccccc1.Cc1ccccc1COc1cc(-n2cnc3ccccc32)sc1C(=O)Nc1ccccc1.NC(=O)c1sc(-n2cnc3ccccc32)cc1OCc1ccccc1
InChIInChI=1S/C27H23N3O2S.C26H21N3O2S.C23H23N3O2S.C22H21N3O3S.C20H17N3O2S.C19H15N3O2S/c1-19-9-5-6-12-21(19)17-32-24-15-25(30-18-29-22-13-7-8-14-23(22)30)33-26(24)27(31)28-16-20-10-3-2-4-11-20;1-18-9-5-6-10-19(18)16-31-23-15-24(29-17-27-21-13-7-8-14-22(21)29)32-25(23)26(30)28-20-11-3-2-4-12-20;1-15(2)25-23(27)22-20(28-13-17-9-5-4-8-16(17)3)12-21(29-22)26-14-24-18-10-6-7-11-19(18)26;1-15-6-2-3-7-16(15)13-28-19-12-20(29-21(19)22(27)23-10-11-26)25-14-24-17-8-4-5-9-18(17)25;1-13-5-4-6-14(9-13)11-25-17-10-18(26-19(17)20(21)24)23-12-22-15-7-2-3-8-16(15)23;20-19(23)18-16(24-11-13-6-2-1-3-7-13)10-17(25-18)22-12-21-14-8-4-5-9-15(14)22/h2-15,18H,16-17H2,1H3,(H,28,31);2-15,17H,16H2,1H3,(H,28,30);4-12,14-15H,13H2,1-3H3,(H,25,27);2-9,12,14,26H,10-11,13H2,1H3,(H,23,27);2-10,12H,11H2,1H3,(H2,21,24);1-10,12H,11H2,(H2,20,23)
InChIKeyJMUNIVAXSWWZHI-UHFFFAOYSA-N
MW2418.98 g/mol
LogP28.78
Rot. Bonds36

About 5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide

5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide (PubChem CID 158962577) has the molecular formula C137H120N18O13S6 and a molecular weight of 2418.98 g/mol. Its IUPAC name is 5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide.

Molecular Properties

Compound Name5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide
PubChem CID158962577
Molecular FormulaC137H120N18O13S6
Molecular Weight2418.98 g/mol
Exact Mass2416.76
IUPAC Name5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide
SMILESCc1cccc(COc2cc(-n3cnc4ccccc43)sc2C(N)=O)c1.Cc1ccccc1COc1cc(-n2cnc3ccccc32)sc1C(=O)NC(C)C.Cc1ccccc1COc1cc(-n2cnc3ccccc32)sc1C(=O)NCCO.Cc1ccccc1COc1cc(-n2cnc3ccccc32)sc1C(=O)NCc1ccccc1.Cc1ccccc1COc1cc(-n2cnc3ccccc32)sc1C(=O)Nc1ccccc1.NC(=O)c1sc(-n2cnc3ccccc32)cc1OCc1ccccc1
InChIInChI=1S/C27H23N3O2S.C26H21N3O2S.C23H23N3O2S.C22H21N3O3S.C20H17N3O2S.C19H15N3O2S/c1-19-9-5-6-12-21(19)17-32-24-15-25(30-18-29-22-13-7-8-14-23(22)30)33-26(24)27(31)28-16-20-10-3-2-4-11-20;1-18-9-5-6-10-19(18)16-31-23-15-24(29-17-27-21-13-7-8-14-22(21)29)32-25(23)26(30)28-20-11-3-2-4-12-20;1-15(2)25-23(27)22-20(28-13-17-9-5-4-8-16(17)3)12-21(29-22)26-14-24-18-10-6-7-11-19(18)26;1-15-6-2-3-7-16(15)13-28-19-12-20(29-21(19)22(27)23-10-11-26)25-14-24-17-8-4-5-9-18(17)25;1-13-5-4-6-14(9-13)11-25-17-10-18(26-19(17)20(21)24)23-12-22-15-7-2-3-8-16(15)23;20-19(23)18-16(24-11-13-6-2-1-3-7-13)10-17(25-18)22-12-21-14-8-4-5-9-15(14)22/h2-15,18H,16-17H2,1H3,(H,28,31);2-15,17H,16H2,1H3,(H,28,30);4-12,14-15H,13H2,1-3H3,(H,25,27);2-9,12,14,26H,10-11,13H2,1H3,(H,23,27);2-10,12H,11H2,1H3,(H2,21,24);1-10,12H,11H2,(H2,20,23)
InChIKeyJMUNIVAXSWWZHI-UHFFFAOYSA-N
XLogP28.78
TPSA385.11 Ų
H-Bond Donors7
H-Bond Acceptors31
Rotatable Bonds36
Heavy Atoms174
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002418.98
LogP ≤ 528.78
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1031

Analyze 5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide with MolForge

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Related Compounds

5-(benzimidazol-1-yl)-N-(1-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide
CID 143036606
5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide
CID 25263074
5-(benzimidazol-1-yl)-3-[(2-chlorophenyl)methoxy]thiophene-2-carboxamide
CID 25263080
methyl 5-(5,6-dimethylbenzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxylate
CID 57431293
methyl 5-(5-fluorobenzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxylate
CID 59855187
3-[(3-aminophenyl)methoxy]-5-(5,6-dimethoxybenzimidazol-1-yl)thiophene-2-carboxamide
CID 11743086
1-[5-carbamoyl-4-[[2-(trifluoromethyl)phenyl]methoxy]thiophen-2-yl]-N-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide;3-[5-carbamoyl-4-[[2-(trifluoromethyl)phenyl]methoxy]thiophen-2-yl]-N-[2-(dimethylamino)ethyl]benzimidazole-5-carboxamide
CID 44528399
5-imidazo[4,5-c]pyridin-3-yl-3-[[4-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide
CID 68764198
2-[(3-methylphenyl)methoxy]-N-phenylbenzamide
CID 18280998
1-(3-methylphenyl)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]benzimidazole-5-carboxamide
CID 154851573
2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide
CID 18160109
3-(benzimidazol-1-yl)-N-[(3-methylphenyl)methyl]propanamide
CID 34166297

Frequently Asked Questions

What is the IUPAC name of 5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide?
The IUPAC name of 5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide (CID 158962577) is 5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide.
What is the SMILES notation for 5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide?
The canonical SMILES for 5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide is Cc1cccc(COc2cc(-n3cnc4ccccc43)sc2C(N)=O)c1.Cc1ccccc1COc1cc(-n2cnc3ccccc32)sc1C(=O)NC(C)C.Cc1ccccc1COc1cc(-n2cnc3ccccc32)sc1C(=O)NCCO.Cc1ccccc1COc1cc(-n2cnc3ccccc32)sc1C(=O)NCc1ccccc1.Cc1ccccc1COc1cc(-n2cnc3ccccc32)sc1C(=O)Nc1ccccc1.NC(=O)c1sc(-n2cnc3ccccc32)cc1OCc1ccccc1.
What is the InChIKey of 5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide?
The InChIKey is JMUNIVAXSWWZHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H23N3O2S.C26H21N3O2S.C23H23N3O2S.C22H21N3O3S.C20H17N3O2S.C19H15N3O2S/c1-19-9-5-6-12-21(19)17-32-24-15-25(30-18-29-22-13-7-8-14-23(22)30)33-26(24)27(31)28-16-20-10-3-2-4-11-20;1-18-9-5-6-10-19(18)16-31-23-15-24(29-17-27-21-13-7-8-14-22(21)29)32-25(23)26(30)28-20-11-3-2-4-12-20;1-15(2)25-23(27)22-20(28-13-17-9-5-4-8-16(17)3)12-21(29-22)26-14-24-18-10-6-7-11-19(18)26;1-15-6-2-3-7-16(15)13-28-19-12-20(29-21(19)22(27)23-10-11-26)25-14-24-17-8-4-5-9-18(17)25;1-13-5-4-6-14(9-13)11-25-17-10-18(26-19(17)20(21)24)23-12-22-15-7-2-3-8-16(15)23;20-19(23)18-16(24-11-13-6-2-1-3-7-13)10-17(25-18)22-12-21-14-8-4-5-9-15(14)22/h2-15,18H,16-17H2,1H3,(H,28,31);2-15,17H,16H2,1H3,(H,28,30);4-12,14-15H,13H2,1-3H3,(H,25,27);2-9,12,14,26H,10-11,13H2,1H3,(H,23,27);2-10,12H,11H2,1H3,(H2,21,24);1-10,12H,11H2,(H2,20,23).
What are the key properties of 5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide?
5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide has a molecular weight of 2418.98 g/mol, XLogP of 28.78, 36 rotatable bonds, 7 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(benzimidazol-1-yl)-N-benzyl-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-N-(2-hydroxyethyl)-3-[(2-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-phenylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]-N-propan-2-ylthiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2-carboxamide;5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide is sourced from PubChem (CID 158962577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).