3-bromo-N-methyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-bromo-N-[(1-phenylbenzimidazol-2-yl)methyl]-N-propylbenzamide;N-butyl-3-chloro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-5-chloro-2-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;5-chloro-2-methoxy-N-methyl-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide — IUPAC name, SMILES, InChIKey & properties

Name: 3-bromo-N-methyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-bromo-N-[(1-phenylbenzimidazol-2-yl)methyl]-N-propylbenzamide;N-butyl-3-chloro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-5-chloro-2-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;5-chloro-2-methoxy-N-methyl-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

About 3-bromo-N-methyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-bromo-N-[(1-phenylbenzimidazol-2-yl)methyl]-N-propylbenzamide;N-butyl-3-chloro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-5-chloro-2-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;5-chloro-2-methoxy-N-methyl-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide

3-bromo-N-methyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-bromo-N-[(1-phenylbenzimidazol-2-yl)methyl]-N-propylbenzamide;N-butyl-3-chloro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-5-chloro-2-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;5-chloro-2-methoxy-N-methyl-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide (PubChem CID 158656030) has the molecular formula C118H114Br2Cl3N15O8 and a molecular weight of 2136.47 g/mol. Its IUPAC name is 3-bromo-N-methyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-bromo-N-[(1-phenylbenzimidazol-2-yl)methyl]-N-propylbenzamide;N-butyl-3-chloro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-5-chloro-2-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;5-chloro-2-methoxy-N-methyl-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide.

Molecular Properties

Compound Name	3-bromo-N-methyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-bromo-N-[(1-phenylbenzimidazol-2-yl)methyl]-N-propylbenzamide;N-butyl-3-chloro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-5-chloro-2-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;5-chloro-2-methoxy-N-methyl-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide
PubChem CID	158656030
Molecular Formula	C118H114Br2Cl3N15O8
Molecular Weight	2136.47 g/mol
Exact Mass	2131.64
IUPAC Name	3-bromo-N-methyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-bromo-N-[(1-phenylbenzimidazol-2-yl)methyl]-N-propylbenzamide;N-butyl-3-chloro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-5-chloro-2-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;5-chloro-2-methoxy-N-methyl-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide
SMILES	CCCCN(Cc1nc2ccccc2n1-c1ccccc1)C(=O)c1cc(Cl)ccc1OC.CCCCN(Cc1nc2ccccc2n1-c1ccccc1)C(=O)c1ccc(OC)c(Cl)c1.CCCN(Cc1nc2ccccc2n1-c1ccccc1)C(=O)c1cccc(Br)c1.CCCn1c(CN(C)C(=O)c2cc(Cl)ccc2OC)nc2ccccc21.CN(Cc1nc2ccccc2n1-c1ccccc1)C(=O)c1cccc(Br)c1
InChI	InChI=1S/2C26H26ClN3O2.C24H22BrN3O.C22H18BrN3O.C20H22ClN3O2/c1-3-4-16-29(26(31)21-17-19(27)14-15-24(21)32-2)18-25-28-22-12-8-9-13-23(22)30(25)20-10-6-5-7-11-20;1-3-4-16-29(26(31)19-14-15-24(32-2)21(27)17-19)18-25-28-22-12-8-9-13-23(22)30(25)20-10-6-5-7-11-20;1-2-15-27(24(29)18-9-8-10-19(25)16-18)17-23-26-21-13-6-7-14-22(21)28(23)20-11-4-3-5-12-20;1-25(22(27)16-8-7-9-17(23)14-16)15-21-24-19-12-5-6-13-20(19)26(21)18-10-3-2-4-11-18;1-4-11-24-17-8-6-5-7-16(17)22-19(24)13-23(2)20(25)15-12-14(21)9-10-18(15)26-3/h2*5-15,17H,3-4,16,18H2,1-2H3;3-14,16H,2,15,17H2,1H3;2-14H,15H2,1H3;5-10,12H,4,11,13H2,1-3H3
InChIKey	ICDNASFHWOLNOR-UHFFFAOYSA-N
XLogP	27.54
TPSA	218.34 Å²
H-Bond Donors
H-Bond Acceptors	18
Rotatable Bonds	32
Heavy Atoms	146
Complexity	—

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2136.47
LogP ≤ 5	27.54
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Analyze 3-bromo-N-methyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-bromo-N-[(1-phenylbenzimidazol-2-yl)methyl]-N-propylbenzamide;N-butyl-3-chloro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-5-chloro-2-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;5-chloro-2-methoxy-N-methyl-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-methyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-bromo-N-[(1-phenylbenzimidazol-2-yl)methyl]-N-propylbenzamide;N-butyl-3-chloro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-5-chloro-2-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;5-chloro-2-methoxy-N-methyl-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide?

The IUPAC name of 3-bromo-N-methyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-bromo-N-[(1-phenylbenzimidazol-2-yl)methyl]-N-propylbenzamide;N-butyl-3-chloro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-5-chloro-2-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;5-chloro-2-methoxy-N-methyl-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide (CID 158656030) is 3-bromo-N-methyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-bromo-N-[(1-phenylbenzimidazol-2-yl)methyl]-N-propylbenzamide;N-butyl-3-chloro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-5-chloro-2-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;5-chloro-2-methoxy-N-methyl-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide.

What is the SMILES notation for 3-bromo-N-methyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-bromo-N-[(1-phenylbenzimidazol-2-yl)methyl]-N-propylbenzamide;N-butyl-3-chloro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-5-chloro-2-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;5-chloro-2-methoxy-N-methyl-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide?

The canonical SMILES for 3-bromo-N-methyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-bromo-N-[(1-phenylbenzimidazol-2-yl)methyl]-N-propylbenzamide;N-butyl-3-chloro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-5-chloro-2-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;5-chloro-2-methoxy-N-methyl-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide is CCCCN(Cc1nc2ccccc2n1-c1ccccc1)C(=O)c1cc(Cl)ccc1OC.CCCCN(Cc1nc2ccccc2n1-c1ccccc1)C(=O)c1ccc(OC)c(Cl)c1.CCCN(Cc1nc2ccccc2n1-c1ccccc1)C(=O)c1cccc(Br)c1.CCCn1c(CN(C)C(=O)c2cc(Cl)ccc2OC)nc2ccccc21.CN(Cc1nc2ccccc2n1-c1ccccc1)C(=O)c1cccc(Br)c1.

What is the InChIKey of 3-bromo-N-methyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-bromo-N-[(1-phenylbenzimidazol-2-yl)methyl]-N-propylbenzamide;N-butyl-3-chloro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-5-chloro-2-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;5-chloro-2-methoxy-N-methyl-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide?

The InChIKey is ICDNASFHWOLNOR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C26H26ClN3O2.C24H22BrN3O.C22H18BrN3O.C20H22ClN3O2/c1-3-4-16-29(26(31)21-17-19(27)14-15-24(21)32-2)18-25-28-22-12-8-9-13-23(22)30(25)20-10-6-5-7-11-20;1-3-4-16-29(26(31)19-14-15-24(32-2)21(27)17-19)18-25-28-22-12-8-9-13-23(22)30(25)20-10-6-5-7-11-20;1-2-15-27(24(29)18-9-8-10-19(25)16-18)17-23-26-21-13-6-7-14-22(21)28(23)20-11-4-3-5-12-20;1-25(22(27)16-8-7-9-17(23)14-16)15-21-24-19-12-5-6-13-20(19)26(21)18-10-3-2-4-11-18;1-4-11-24-17-8-6-5-7-16(17)22-19(24)13-23(2)20(25)15-12-14(21)9-10-18(15)26-3/h2*5-15,17H,3-4,16,18H2,1-2H3;3-14,16H,2,15,17H2,1H3;2-14H,15H2,1H3;5-10,12H,4,11,13H2,1-3H3.

What are the key properties of 3-bromo-N-methyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-bromo-N-[(1-phenylbenzimidazol-2-yl)methyl]-N-propylbenzamide;N-butyl-3-chloro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-5-chloro-2-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;5-chloro-2-methoxy-N-methyl-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide?

Where does this data come from?

All data for 3-bromo-N-methyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-bromo-N-[(1-phenylbenzimidazol-2-yl)methyl]-N-propylbenzamide;N-butyl-3-chloro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-5-chloro-2-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;5-chloro-2-methoxy-N-methyl-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide is sourced from PubChem (CID 158656030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).