(6-chloro-2-pyridin-2-yl-3H-benzimidazol-5-yl)methanol;4,6-dichloro-2-pyridin-2-yl-1H-benzimidazole;6-methyl-2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazole;6-piperidin-1-yl-2-pyridin-2-yl-1H-benzimidazole;4-(2-pyridin-2-yl-3H-benzimidazol-5-yl)morpholine;2-pyridin-2-yl-6-pyrrolidin-1-yl-1H-benzimidazole

C88H77Cl3F3N21O2 — CID 162161681

About (6-chloro-2-pyridin-2-yl-3H-benzimidazol-5-yl)methanol;4,6-dichloro-2-pyridin-2-yl-1H-benzimidazole;6-methyl-2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazole;6-piperidin-1-yl-2-pyridin-2-yl-1H-benzimidazole;4-(2-pyridin-2-yl-3H-benzimidazol-5-yl)morpholine;2-pyridin-2-yl-6-pyrrolidin-1-yl-1H-benzimidazole

(6-chloro-2-pyridin-2-yl-3H-benzimidazol-5-yl)methanol;4,6-dichloro-2-pyridin-2-yl-1H-benzimidazole;6-methyl-2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazole;6-piperidin-1-yl-2-pyridin-2-yl-1H-benzimidazole;4-(2-pyridin-2-yl-3H-benzimidazol-5-yl)morpholine;2-pyridin-2-yl-6-pyrrolidin-1-yl-1H-benzimidazole (PubChem CID 162161681) has the molecular formula C88H77Cl3F3N21O2 and a molecular weight of 1624.08 g/mol. Its IUPAC name is (6-chloro-2-pyridin-2-yl-3H-benzimidazol-5-yl)methanol;4,6-dichloro-2-pyridin-2-yl-1H-benzimidazole;6-methyl-2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazole;6-piperidin-1-yl-2-pyridin-2-yl-1H-benzimidazole;4-(2-pyridin-2-yl-3H-benzimidazol-5-yl)morpholine;2-pyridin-2-yl-6-pyrrolidin-1-yl-1H-benzimidazole.

Molecular Properties

• Compound Name: (6-chloro-2-pyridin-2-yl-3H-benzimidazol-5-yl)methanol;4,6-dichloro-2-pyridin-2-yl-1H-benzimidazole;6-methyl-2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazole;6-piperidin-1-yl-2-pyridin-2-yl-1H-benzimidazole;4-(2-pyridin-2-yl-3H-benzimidazol-5-yl)morpholine;2-pyridin-2-yl-6-pyrrolidin-1-yl-1H-benzimidazole
• PubChem CID: 162161681
• Molecular Formula: C88H77Cl3F3N21O2
• Molecular Weight: 1624.08 g/mol
• Exact Mass: 1621.56
• IUPAC Name: (6-chloro-2-pyridin-2-yl-3H-benzimidazol-5-yl)methanol;4,6-dichloro-2-pyridin-2-yl-1H-benzimidazole;6-methyl-2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazole;6-piperidin-1-yl-2-pyridin-2-yl-1H-benzimidazole;4-(2-pyridin-2-yl-3H-benzimidazol-5-yl)morpholine;2-pyridin-2-yl-6-pyrrolidin-1-yl-1H-benzimidazole
• SMILES: Cc1cc(C(F)(F)F)c2nc(-c3ccccn3)[nH]c2c1.Clc1cc(Cl)c2nc(-c3ccccn3)[nH]c2c1.OCc1cc2[nH]c(-c3ccccn3)nc2cc1Cl.c1ccc(-c2nc3ccc(N4CCCC4)cc3[nH]2)nc1.c1ccc(-c2nc3ccc(N4CCCCC4)cc3[nH]2)nc1.c1ccc(-c2nc3ccc(N4CCOCC4)cc3[nH]2)nc1
• InChI: InChI=1S/C17H18N4.C16H16N4O.C16H16N4.C14H10F3N3.C13H10ClN3O.C12H7Cl2N3/c1-4-10-21(11-5-1)13-7-8-14-16(12-13)20-17(19-14)15-6-2-3-9-18-15;1-2-6-17-14(3-1)16-18-13-5-4-12(11-15(13)19-16)20-7-9-21-10-8-20;1-2-8-17-14(5-1)16-18-13-7-6-12(11-15(13)19-16)20-9-3-4-10-20;1-8-6-9(14(15,16)17)12-11(7-8)19-13(20-12)10-4-2-3-5-18-10;14-9-6-12-11(5-8(9)7-18)16-13(17-12)10-3-1-2-4-15-10;13-7-5-8(14)11-10(6-7)16-12(17-11)9-3-1-2-4-15-9/h2-3,6-9,12H,1,4-5,10-11H2,(H,19,20);1-6,11H,7-10H2,(H,18,19);1-2,5-8,11H,3-4,9-10H2,(H,18,19);2-7H,1H3,(H,19,20);1-6,18H,7H2,(H,16,17);1-6H,(H,16,17)
• InChIKey: ZMOJWPDUIBQWBL-UHFFFAOYSA-N
• XLogP: 19.96
• TPSA: 288.60 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 17
• Rotatable Bonds: 10
• Heavy Atoms: 117
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1624.08
LogP ≤ 5	19.96
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	17

Frequently Asked Questions

What is the IUPAC name of (6-chloro-2-pyridin-2-yl-3H-benzimidazol-5-yl)methanol;4,6-dichloro-2-pyridin-2-yl-1H-benzimidazole;6-methyl-2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazole;6-piperidin-1-yl-2-pyridin-2-yl-1H-benzimidazole;4-(2-pyridin-2-yl-3H-benzimidazol-5-yl)morpholine;2-pyridin-2-yl-6-pyrrolidin-1-yl-1H-benzimidazole?

The IUPAC name of (6-chloro-2-pyridin-2-yl-3H-benzimidazol-5-yl)methanol;4,6-dichloro-2-pyridin-2-yl-1H-benzimidazole;6-methyl-2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazole;6-piperidin-1-yl-2-pyridin-2-yl-1H-benzimidazole;4-(2-pyridin-2-yl-3H-benzimidazol-5-yl)morpholine;2-pyridin-2-yl-6-pyrrolidin-1-yl-1H-benzimidazole (CID 162161681) is (6-chloro-2-pyridin-2-yl-3H-benzimidazol-5-yl)methanol;4,6-dichloro-2-pyridin-2-yl-1H-benzimidazole;6-methyl-2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazole;6-piperidin-1-yl-2-pyridin-2-yl-1H-benzimidazole;4-(2-pyridin-2-yl-3H-benzimidazol-5-yl)morpholine;2-pyridin-2-yl-6-pyrrolidin-1-yl-1H-benzimidazole.

What is the SMILES notation for (6-chloro-2-pyridin-2-yl-3H-benzimidazol-5-yl)methanol;4,6-dichloro-2-pyridin-2-yl-1H-benzimidazole;6-methyl-2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazole;6-piperidin-1-yl-2-pyridin-2-yl-1H-benzimidazole;4-(2-pyridin-2-yl-3H-benzimidazol-5-yl)morpholine;2-pyridin-2-yl-6-pyrrolidin-1-yl-1H-benzimidazole?

The canonical SMILES for (6-chloro-2-pyridin-2-yl-3H-benzimidazol-5-yl)methanol;4,6-dichloro-2-pyridin-2-yl-1H-benzimidazole;6-methyl-2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazole;6-piperidin-1-yl-2-pyridin-2-yl-1H-benzimidazole;4-(2-pyridin-2-yl-3H-benzimidazol-5-yl)morpholine;2-pyridin-2-yl-6-pyrrolidin-1-yl-1H-benzimidazole is Cc1cc(C(F)(F)F)c2nc(-c3ccccn3)[nH]c2c1.Clc1cc(Cl)c2nc(-c3ccccn3)[nH]c2c1.OCc1cc2[nH]c(-c3ccccn3)nc2cc1Cl.c1ccc(-c2nc3ccc(N4CCCC4)cc3[nH]2)nc1.c1ccc(-c2nc3ccc(N4CCCCC4)cc3[nH]2)nc1.c1ccc(-c2nc3ccc(N4CCOCC4)cc3[nH]2)nc1.

What is the InChIKey of (6-chloro-2-pyridin-2-yl-3H-benzimidazol-5-yl)methanol;4,6-dichloro-2-pyridin-2-yl-1H-benzimidazole;6-methyl-2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazole;6-piperidin-1-yl-2-pyridin-2-yl-1H-benzimidazole;4-(2-pyridin-2-yl-3H-benzimidazol-5-yl)morpholine;2-pyridin-2-yl-6-pyrrolidin-1-yl-1H-benzimidazole?

The InChIKey is ZMOJWPDUIBQWBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4.C16H16N4O.C16H16N4.C14H10F3N3.C13H10ClN3O.C12H7Cl2N3/c1-4-10-21(11-5-1)13-7-8-14-16(12-13)20-17(19-14)15-6-2-3-9-18-15;1-2-6-17-14(3-1)16-18-13-5-4-12(11-15(13)19-16)20-7-9-21-10-8-20;1-2-8-17-14(5-1)16-18-13-7-6-12(11-15(13)19-16)20-9-3-4-10-20;1-8-6-9(14(15,16)17)12-11(7-8)19-13(20-12)10-4-2-3-5-18-10;14-9-6-12-11(5-8(9)7-18)16-13(17-12)10-3-1-2-4-15-10;13-7-5-8(14)11-10(6-7)16-12(17-11)9-3-1-2-4-15-9/h2-3,6-9,12H,1,4-5,10-11H2,(H,19,20);1-6,11H,7-10H2,(H,18,19);1-2,5-8,11H,3-4,9-10H2,(H,18,19);2-7H,1H3,(H,19,20);1-6,18H,7H2,(H,16,17);1-6H,(H,16,17).

What are the key properties of (6-chloro-2-pyridin-2-yl-3H-benzimidazol-5-yl)methanol;4,6-dichloro-2-pyridin-2-yl-1H-benzimidazole;6-methyl-2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazole;6-piperidin-1-yl-2-pyridin-2-yl-1H-benzimidazole;4-(2-pyridin-2-yl-3H-benzimidazol-5-yl)morpholine;2-pyridin-2-yl-6-pyrrolidin-1-yl-1H-benzimidazole?

(6-chloro-2-pyridin-2-yl-3H-benzimidazol-5-yl)methanol;4,6-dichloro-2-pyridin-2-yl-1H-benzimidazole;6-methyl-2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazole;6-piperidin-1-yl-2-pyridin-2-yl-1H-benzimidazole;4-(2-pyridin-2-yl-3H-benzimidazol-5-yl)morpholine;2-pyridin-2-yl-6-pyrrolidin-1-yl-1H-benzimidazole has a molecular weight of 1624.08 g/mol, XLogP of 19.96, 10 rotatable bonds, 7 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for (6-chloro-2-pyridin-2-yl-3H-benzimidazol-5-yl)methanol;4,6-dichloro-2-pyridin-2-yl-1H-benzimidazole;6-methyl-2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazole;6-piperidin-1-yl-2-pyridin-2-yl-1H-benzimidazole;4-(2-pyridin-2-yl-3H-benzimidazol-5-yl)morpholine;2-pyridin-2-yl-6-pyrrolidin-1-yl-1H-benzimidazole is sourced from PubChem (CID 162161681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).