3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide

C154H162Cl8FN21O7 — CID 158220653

IUPAC3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide
SMILESC=CCN(Cc1nc2ccc(Cl)cc2n1CC1CC1)C(=O)c1cccc(C)c1.C=CCN(Cc1nc2ccc(Cl)cc2n1CC1CC1)C(=O)c1ccccc1.CCCN(Cc1nc2ccc(Cl)cc2n1C1CCCC1)C(=O)c1ccc(F)c(Cl)c1.CCCN(Cc1nc2ccc(Cl)cc2n1CC1CC1)C(=O)c1cccc(C)c1.CCCN(Cc1nc2ccc(Cl)cc2n1CC1CC1)C(=O)c1ccccc1.CN(Cc1nc2ccc(Cl)cc2n1CC1CC1)C(=O)c1ccccc1.Cc1cccc(C(=O)N(C)Cc2nc3ccc(Cl)cc3n2CC2CC2)c1
InChIInChI=1S/C23H24Cl2FN3O.C23H26ClN3O.C23H24ClN3O.C22H24ClN3O.C22H22ClN3O.C21H22ClN3O.C20H20ClN3O/c1-2-11-28(23(30)15-7-9-19(26)18(25)12-15)14-22-27-20-10-8-16(24)13-21(20)29(22)17-5-3-4-6-17;2*1-3-11-26(23(28)18-6-4-5-16(2)12-18)15-22-25-20-10-9-19(24)13-21(20)27(22)14-17-7-8-17;2*1-2-12-25(22(27)17-6-4-3-5-7-17)15-21-24-19-11-10-18(23)13-20(19)26(21)14-16-8-9-16;1-14-4-3-5-16(10-14)21(26)24(2)13-20-23-18-9-8-17(22)11-19(18)25(20)12-15-6-7-15;1-23(20(25)15-5-3-2-4-6-15)13-19-22-17-10-9-16(21)11-18(17)24(19)12-14-7-8-14/h7-10,12-13,17H,2-6,11,14H2,1H3;4-6,9-10,12-13,17H,3,7-8,11,14-15H2,1-2H3;3-6,9-10,12-13,17H,1,7-8,11,14-15H2,2H3;3-7,10-11,13,16H,2,8-9,12,14-15H2,1H3;2-7,10-11,13,16H,1,8-9,12,14-15H2;3-5,8-11,15H,6-7,12-13H2,1-2H3;2-6,9-11,14H,7-8,12-13H2,1H3
InChIKeyGDEWIWHLQFCXMR-UHFFFAOYSA-N
MW2721.75 g/mol
LogP36.48
Rot. Bonds44

About 3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide

3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide (PubChem CID 158220653) has the molecular formula C154H162Cl8FN21O7 and a molecular weight of 2721.75 g/mol. Its IUPAC name is 3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide.

Molecular Properties

Compound Name3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide
PubChem CID158220653
Molecular FormulaC154H162Cl8FN21O7
Molecular Weight2721.75 g/mol
Exact Mass2716.05
IUPAC Name3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide
SMILESC=CCN(Cc1nc2ccc(Cl)cc2n1CC1CC1)C(=O)c1cccc(C)c1.C=CCN(Cc1nc2ccc(Cl)cc2n1CC1CC1)C(=O)c1ccccc1.CCCN(Cc1nc2ccc(Cl)cc2n1C1CCCC1)C(=O)c1ccc(F)c(Cl)c1.CCCN(Cc1nc2ccc(Cl)cc2n1CC1CC1)C(=O)c1cccc(C)c1.CCCN(Cc1nc2ccc(Cl)cc2n1CC1CC1)C(=O)c1ccccc1.CN(Cc1nc2ccc(Cl)cc2n1CC1CC1)C(=O)c1ccccc1.Cc1cccc(C(=O)N(C)Cc2nc3ccc(Cl)cc3n2CC2CC2)c1
InChIInChI=1S/C23H24Cl2FN3O.C23H26ClN3O.C23H24ClN3O.C22H24ClN3O.C22H22ClN3O.C21H22ClN3O.C20H20ClN3O/c1-2-11-28(23(30)15-7-9-19(26)18(25)12-15)14-22-27-20-10-8-16(24)13-21(20)29(22)17-5-3-4-6-17;2*1-3-11-26(23(28)18-6-4-5-16(2)12-18)15-22-25-20-10-9-19(24)13-21(20)27(22)14-17-7-8-17;2*1-2-12-25(22(27)17-6-4-3-5-7-17)15-21-24-19-11-10-18(23)13-20(19)26(21)14-16-8-9-16;1-14-4-3-5-16(10-14)21(26)24(2)13-20-23-18-9-8-17(22)11-19(18)25(20)12-15-6-7-15;1-23(20(25)15-5-3-2-4-6-15)13-19-22-17-10-9-16(21)11-18(17)24(19)12-14-7-8-14/h7-10,12-13,17H,2-6,11,14H2,1H3;4-6,9-10,12-13,17H,3,7-8,11,14-15H2,1-2H3;3-6,9-10,12-13,17H,1,7-8,11,14-15H2,2H3;3-7,10-11,13,16H,2,8-9,12,14-15H2,1H3;2-7,10-11,13,16H,1,8-9,12,14-15H2;3-5,8-11,15H,6-7,12-13H2,1-2H3;2-6,9-11,14H,7-8,12-13H2,1H3
InChIKeyGDEWIWHLQFCXMR-UHFFFAOYSA-N
XLogP36.48
TPSA266.91 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds44
Heavy Atoms191
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002721.75
LogP ≤ 536.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

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

Analyze 3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide?
The IUPAC name of 3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide (CID 158220653) is 3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide.
What is the SMILES notation for 3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide?
The canonical SMILES for 3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide is C=CCN(Cc1nc2ccc(Cl)cc2n1CC1CC1)C(=O)c1cccc(C)c1.C=CCN(Cc1nc2ccc(Cl)cc2n1CC1CC1)C(=O)c1ccccc1.CCCN(Cc1nc2ccc(Cl)cc2n1C1CCCC1)C(=O)c1ccc(F)c(Cl)c1.CCCN(Cc1nc2ccc(Cl)cc2n1CC1CC1)C(=O)c1cccc(C)c1.CCCN(Cc1nc2ccc(Cl)cc2n1CC1CC1)C(=O)c1ccccc1.CN(Cc1nc2ccc(Cl)cc2n1CC1CC1)C(=O)c1ccccc1.Cc1cccc(C(=O)N(C)Cc2nc3ccc(Cl)cc3n2CC2CC2)c1.
What is the InChIKey of 3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide?
The InChIKey is GDEWIWHLQFCXMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24Cl2FN3O.C23H26ClN3O.C23H24ClN3O.C22H24ClN3O.C22H22ClN3O.C21H22ClN3O.C20H20ClN3O/c1-2-11-28(23(30)15-7-9-19(26)18(25)12-15)14-22-27-20-10-8-16(24)13-21(20)29(22)17-5-3-4-6-17;2*1-3-11-26(23(28)18-6-4-5-16(2)12-18)15-22-25-20-10-9-19(24)13-21(20)27(22)14-17-7-8-17;2*1-2-12-25(22(27)17-6-4-3-5-7-17)15-21-24-19-11-10-18(23)13-20(19)26(21)14-16-8-9-16;1-14-4-3-5-16(10-14)21(26)24(2)13-20-23-18-9-8-17(22)11-19(18)25(20)12-15-6-7-15;1-23(20(25)15-5-3-2-4-6-15)13-19-22-17-10-9-16(21)11-18(17)24(19)12-14-7-8-14/h7-10,12-13,17H,2-6,11,14H2,1H3;4-6,9-10,12-13,17H,3,7-8,11,14-15H2,1-2H3;3-6,9-10,12-13,17H,1,7-8,11,14-15H2,2H3;3-7,10-11,13,16H,2,8-9,12,14-15H2,1H3;2-7,10-11,13,16H,1,8-9,12,14-15H2;3-5,8-11,15H,6-7,12-13H2,1-2H3;2-6,9-11,14H,7-8,12-13H2,1H3.
What are the key properties of 3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide?
3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide has a molecular weight of 2721.75 g/mol, XLogP of 36.48, 44 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[(6-chloro-1-cyclopentylbenzimidazol-2-yl)methyl]-4-fluoro-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N,3-dimethylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-methylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3-methyl-N-propylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-prop-2-enylbenzamide;N-[[6-chloro-1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-N-propylbenzamide is sourced from PubChem (CID 158220653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).