C148H191N25O10 — CID 160978797
N-[1-[4-(tert-butylcarbamoyl)cyclohexyl]-6-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide;N-[1-(4-carbamoylcyclohexyl)-6-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide;N-[1-[4-(diethylcarbamoyl)cyclohexyl]-6-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide;N-[1-[4-(ethylcarbamoyl)cyclohexyl]-6-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide;N-[6-(piperidin-1-ylmethyl)-1-[4-(propan-2-ylcarbamoyl)cyclohexyl]benzimidazol-2-yl]benzamide (PubChem CID 160978797) has the molecular formula C148H191N25O10 and a molecular weight of 2480.32 g/mol. Its IUPAC name is N-[1-[4-(tert-butylcarbamoyl)cyclohexyl]-6-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide;N-[1-(4-carbamoylcyclohexyl)-6-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide;N-[1-[4-(diethylcarbamoyl)cyclohexyl]-6-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide;N-[1-[4-(ethylcarbamoyl)cyclohexyl]-6-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide;N-[6-(piperidin-1-ylmethyl)-1-[4-(propan-2-ylcarbamoyl)cyclohexyl]benzimidazol-2-yl]benzamide.
| Compound Name | N-[1-[4-(tert-butylcarbamoyl)cyclohexyl]-6-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide;N-[1-(4-carbamoylcyclohexyl)-6-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide;N-[1-[4-(diethylcarbamoyl)cyclohexyl]-6-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide;N-[1-[4-(ethylcarbamoyl)cyclohexyl]-6-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide;N-[6-(piperidin-1-ylmethyl)-1-[4-(propan-2-ylcarbamoyl)cyclohexyl]benzimidazol-2-yl]benzamide |
|---|---|
| PubChem CID | 160978797 |
| Molecular Formula | C148H191N25O10 |
| Molecular Weight | 2480.32 g/mol |
| Exact Mass | 2478.52 |
| IUPAC Name | N-[1-[4-(tert-butylcarbamoyl)cyclohexyl]-6-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide;N-[1-(4-carbamoylcyclohexyl)-6-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide;N-[1-[4-(diethylcarbamoyl)cyclohexyl]-6-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide;N-[1-[4-(ethylcarbamoyl)cyclohexyl]-6-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide;N-[6-(piperidin-1-ylmethyl)-1-[4-(propan-2-ylcarbamoyl)cyclohexyl]benzimidazol-2-yl]benzamide |
| SMILES | CC(C)(C)NC(=O)C1CCC(n2c(NC(=O)c3ccccc3)nc3ccc(CN4CCCCC4)cc32)CC1.CC(C)NC(=O)C1CCC(n2c(NC(=O)c3ccccc3)nc3ccc(CN4CCCCC4)cc32)CC1.CCN(CC)C(=O)C1CCC(n2c(NC(=O)c3ccccc3)nc3ccc(CN4CCCCC4)cc32)CC1.CCNC(=O)C1CCC(n2c(NC(=O)c3ccccc3)nc3ccc(CN4CCCCC4)cc32)CC1.NC(=O)C1CCC(n2c(NC(=O)c3ccccc3)nc3ccc(CN4CCCCC4)cc32)CC1 |
| InChI | InChI=1S/2C31H41N5O2.C30H39N5O2.C29H37N5O2.C27H33N5O2/c1-31(2,3)34-29(38)24-13-15-25(16-14-24)36-27-20-22(21-35-18-8-5-9-19-35)12-17-26(27)32-30(36)33-28(37)23-10-6-4-7-11-23;1-3-35(4-2)30(38)25-14-16-26(17-15-25)36-28-21-23(22-34-19-9-6-10-20-34)13-18-27(28)32-31(36)33-29(37)24-11-7-5-8-12-24;1-21(2)31-28(36)24-12-14-25(15-13-24)35-27-19-22(20-34-17-7-4-8-18-34)11-16-26(27)32-30(35)33-29(37)23-9-5-3-6-10-23;1-2-30-27(35)23-12-14-24(15-13-23)34-26-19-21(20-33-17-7-4-8-18-33)11-16-25(26)31-29(34)32-28(36)22-9-5-3-6-10-22;28-25(33)20-10-12-22(13-11-20)32-24-17-19(18-31-15-5-2-6-16-31)9-14-23(24)29-27(32)30-26(34)21-7-3-1-4-8-21/h4,6-7,10-12,17,20,24-25H,5,8-9,13-16,18-19,21H2,1-3H3,(H,34,38)(H,32,33,37);5,7-8,11-13,18,21,25-26H,3-4,6,9-10,14-17,19-20,22H2,1-2H3,(H,32,33,37);3,5-6,9-11,16,19,21,24-25H,4,7-8,12-15,17-18,20H2,1-2H3,(H,31,36)(H,32,33,37);3,5-6,9-11,16,19,23-24H,2,4,7-8,12-15,17-18,20H2,1H3,(H,30,35)(H,31,32,36);1,3-4,7-9,14,17,20,22H,2,5-6,10-13,15-16,18H2,(H2,28,33)(H,29,30,34) |
| InChIKey | SZFUQYLEUMLQGD-UHFFFAOYSA-N |
| XLogP | 26.96 |
| TPSA | 401.50 Ų |
| H-Bond Donors | 9 |
| H-Bond Acceptors | 25 |
| Rotatable Bonds | 34 |
| Heavy Atoms | 183 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2480.32 |
| LogP ≤ 5 | 26.96 |
| H-Bond Donors ≤ 5 | 9 |
| H-Bond Acceptors ≤ 10 | 25 |