3-chloro-N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-methylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-5-hydroxy-2-methoxy-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-N-propyl-1,3-benzodioxole-5-carboxamide

C147H154Cl8F7N21O11 — CID 158158921

About 3-chloro-N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-methylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-5-hydroxy-2-methoxy-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-N-propyl-1,3-benzodioxole-5-carboxamide

3-chloro-N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-methylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-5-hydroxy-2-methoxy-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-N-propyl-1,3-benzodioxole-5-carboxamide (PubChem CID 158158921) has the molecular formula C147H154Cl8F7N21O11 and a molecular weight of 2807.59 g/mol. Its IUPAC name is 3-chloro-N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-methylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-5-hydroxy-2-methoxy-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-N-propyl-1,3-benzodioxole-5-carboxamide.

Molecular Properties

• Compound Name: 3-chloro-N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-methylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-5-hydroxy-2-methoxy-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-N-propyl-1,3-benzodioxole-5-carboxamide
• PubChem CID: 158158921
• Molecular Formula: C147H154Cl8F7N21O11
• Molecular Weight: 2807.59 g/mol
• Exact Mass: 2801.95
• IUPAC Name: 3-chloro-N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-methylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-5-hydroxy-2-methoxy-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-N-propyl-1,3-benzodioxole-5-carboxamide
• SMILES: C=CCN(Cc1nc2ccc(Cl)cc2n1CCC)C(=O)c1cc(O)ccc1OC.C=CCN(Cc1nc2ccc(Cl)cc2n1CCC)C(=O)c1ccccc1F.CCCN(Cc1nc2ccc(Cl)cc2n1CCC)C(=O)c1cc(F)ccc1F.CCCN(Cc1nc2ccc(Cl)cc2n1CCC)C(=O)c1ccc(F)c(Cl)c1.CCCN(Cc1nc2ccc(Cl)cc2n1CCC)C(=O)c1ccc2c(c1)OCO2.CCCN(Cc1nc2ccc(Cl)cc2n1CCC)C(=O)c1ccccc1F.CCCn1c(CN(C)C(=O)c2cc(F)ccc2F)nc2ccc(Cl)cc21
• InChI: InChI=1S/2C22H24ClN3O3.C21H22Cl2FN3O.C21H22ClF2N3O.C21H23ClFN3O.C21H21ClFN3O.C19H18ClF2N3O/c1-3-9-25(22(27)15-5-8-19-20(11-15)29-14-28-19)13-21-24-17-7-6-16(23)12-18(17)26(21)10-4-2;1-4-10-25(22(28)17-13-16(27)7-9-20(17)29-3)14-21-24-18-8-6-15(23)12-19(18)26(21)11-5-2;1-3-9-26(21(28)14-5-7-17(24)16(23)11-14)13-20-25-18-8-6-15(22)12-19(18)27(20)10-4-2;1-3-9-26(21(28)16-12-15(23)6-7-17(16)24)13-20-25-18-8-5-14(22)11-19(18)27(20)10-4-2;2*1-3-11-25(21(27)16-7-5-6-8-17(16)23)14-20-24-18-10-9-15(22)13-19(18)26(20)12-4-2;1-3-8-25-17-9-12(20)4-7-16(17)23-18(25)11-24(2)19(26)14-10-13(21)5-6-15(14)22/h5-8,11-12H,3-4,9-10,13-14H2,1-2H3;4,6-9,12-13,27H,1,5,10-11,14H2,2-3H3;2*5-8,11-12H,3-4,9-10,13H2,1-2H3;5-10,13H,3-4,11-12,14H2,1-2H3;3,5-10,13H,1,4,11-12,14H2,2H3;4-7,9-10H,3,8,11H2,1-2H3
• InChIKey: FWALEEPYJQKZDL-UHFFFAOYSA-N
• XLogP: 35.91
• TPSA: 314.83 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 25
• Rotatable Bonds: 48
• Heavy Atoms: 194
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2807.59
LogP ≤ 5	35.91
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-methylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-5-hydroxy-2-methoxy-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-N-propyl-1,3-benzodioxole-5-carboxamide?

The IUPAC name of 3-chloro-N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-methylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-5-hydroxy-2-methoxy-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-N-propyl-1,3-benzodioxole-5-carboxamide (CID 158158921) is 3-chloro-N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-methylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-5-hydroxy-2-methoxy-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-N-propyl-1,3-benzodioxole-5-carboxamide.

What is the SMILES notation for 3-chloro-N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-methylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-5-hydroxy-2-methoxy-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-N-propyl-1,3-benzodioxole-5-carboxamide?

The canonical SMILES for 3-chloro-N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-methylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-5-hydroxy-2-methoxy-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-N-propyl-1,3-benzodioxole-5-carboxamide is C=CCN(Cc1nc2ccc(Cl)cc2n1CCC)C(=O)c1cc(O)ccc1OC.C=CCN(Cc1nc2ccc(Cl)cc2n1CCC)C(=O)c1ccccc1F.CCCN(Cc1nc2ccc(Cl)cc2n1CCC)C(=O)c1cc(F)ccc1F.CCCN(Cc1nc2ccc(Cl)cc2n1CCC)C(=O)c1ccc(F)c(Cl)c1.CCCN(Cc1nc2ccc(Cl)cc2n1CCC)C(=O)c1ccc2c(c1)OCO2.CCCN(Cc1nc2ccc(Cl)cc2n1CCC)C(=O)c1ccccc1F.CCCn1c(CN(C)C(=O)c2cc(F)ccc2F)nc2ccc(Cl)cc21.

What is the InChIKey of 3-chloro-N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-methylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-5-hydroxy-2-methoxy-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-N-propyl-1,3-benzodioxole-5-carboxamide?

The InChIKey is FWALEEPYJQKZDL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C22H24ClN3O3.C21H22Cl2FN3O.C21H22ClF2N3O.C21H23ClFN3O.C21H21ClFN3O.C19H18ClF2N3O/c1-3-9-25(22(27)15-5-8-19-20(11-15)29-14-28-19)13-21-24-17-7-6-16(23)12-18(17)26(21)10-4-2;1-4-10-25(22(28)17-13-16(27)7-9-20(17)29-3)14-21-24-18-8-6-15(23)12-19(18)26(21)11-5-2;1-3-9-26(21(28)14-5-7-17(24)16(23)11-14)13-20-25-18-8-6-15(22)12-19(18)27(20)10-4-2;1-3-9-26(21(28)16-12-15(23)6-7-17(16)24)13-20-25-18-8-5-14(22)11-19(18)27(20)10-4-2;2*1-3-11-25(21(27)16-7-5-6-8-17(16)23)14-20-24-18-10-9-15(22)13-19(18)26(20)12-4-2;1-3-8-25-17-9-12(20)4-7-16(17)23-18(25)11-24(2)19(26)14-10-13(21)5-6-15(14)22/h5-8,11-12H,3-4,9-10,13-14H2,1-2H3;4,6-9,12-13,27H,1,5,10-11,14H2,2-3H3;2*5-8,11-12H,3-4,9-10,13H2,1-2H3;5-10,13H,3-4,11-12,14H2,1-2H3;3,5-10,13H,1,4,11-12,14H2,2H3;4-7,9-10H,3,8,11H2,1-2H3.

What are the key properties of 3-chloro-N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-methylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-5-hydroxy-2-methoxy-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-N-propyl-1,3-benzodioxole-5-carboxamide?

3-chloro-N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-methylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-5-hydroxy-2-methoxy-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-N-propyl-1,3-benzodioxole-5-carboxamide has a molecular weight of 2807.59 g/mol, XLogP of 35.91, 48 rotatable bonds, 1 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 3-chloro-N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-methylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2,5-difluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-2-fluoro-N-propylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-5-hydroxy-2-methoxy-N-prop-2-enylbenzamide;N-[(6-chloro-1-propylbenzimidazol-2-yl)methyl]-N-propyl-1,3-benzodioxole-5-carboxamide is sourced from PubChem (CID 158158921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).