[4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-3,5-dimethylphenyl]-pyrrolidin-1-ylmethanone;4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-N,N,3,5-tetramethylbenzamide;(2-benzylpiperidin-1-yl)-[4-[4-(2,4-dimethyl-3-pyridinyl)phenyl]triazol-1-yl]methanone;bis((2-benzylpiperidin-1-yl)-[4-[4-(4,6-dimethylpyrimidin-5-yl)phenyl]triazol-1-yl]methanone);(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-1-yl]methanone;(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-2-yl]methanone

C196H213N35O9 — CID 158572800

About [4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-3,5-dimethylphenyl]-pyrrolidin-1-ylmethanone;4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-N,N,3,5-tetramethylbenzamide;(2-benzylpiperidin-1-yl)-[4-[4-(2,4-dimethyl-3-pyridinyl)phenyl]triazol-1-yl]methanone;bis((2-benzylpiperidin-1-yl)-[4-[4-(4,6-dimethylpyrimidin-5-yl)phenyl]triazol-1-yl]methanone);(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-1-yl]methanone;(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-2-yl]methanone

[4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-3,5-dimethylphenyl]-pyrrolidin-1-ylmethanone;4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-N,N,3,5-tetramethylbenzamide;(2-benzylpiperidin-1-yl)-[4-[4-(2,4-dimethyl-3-pyridinyl)phenyl]triazol-1-yl]methanone;bis((2-benzylpiperidin-1-yl)-[4-[4-(4,6-dimethylpyrimidin-5-yl)phenyl]triazol-1-yl]methanone);(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-1-yl]methanone;(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-2-yl]methanone (PubChem CID 158572800) has the molecular formula C196H213N35O9 and a molecular weight of 3203.10 g/mol. Its IUPAC name is [4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-3,5-dimethylphenyl]-pyrrolidin-1-ylmethanone;4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-N,N,3,5-tetramethylbenzamide;(2-benzylpiperidin-1-yl)-[4-[4-(2,4-dimethyl-3-pyridinyl)phenyl]triazol-1-yl]methanone;bis((2-benzylpiperidin-1-yl)-[4-[4-(4,6-dimethylpyrimidin-5-yl)phenyl]triazol-1-yl]methanone);(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-1-yl]methanone;(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-2-yl]methanone.

Molecular Properties

• Compound Name: [4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-3,5-dimethylphenyl]-pyrrolidin-1-ylmethanone;4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-N,N,3,5-tetramethylbenzamide;(2-benzylpiperidin-1-yl)-[4-[4-(2,4-dimethyl-3-pyridinyl)phenyl]triazol-1-yl]methanone;bis((2-benzylpiperidin-1-yl)-[4-[4-(4,6-dimethylpyrimidin-5-yl)phenyl]triazol-1-yl]methanone);(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-1-yl]methanone;(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-2-yl]methanone
• PubChem CID: 158572800
• Molecular Formula: C196H213N35O9
• Molecular Weight: 3203.10 g/mol
• Exact Mass: 3200.73
• IUPAC Name: [4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-3,5-dimethylphenyl]-pyrrolidin-1-ylmethanone;4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-N,N,3,5-tetramethylbenzamide;(2-benzylpiperidin-1-yl)-[4-[4-(2,4-dimethyl-3-pyridinyl)phenyl]triazol-1-yl]methanone;bis((2-benzylpiperidin-1-yl)-[4-[4-(4,6-dimethylpyrimidin-5-yl)phenyl]triazol-1-yl]methanone);(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-1-yl]methanone;(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-2-yl]methanone
• SMILES: Cc1cc(C(=O)N(C)C)cc(C)c1-c1ccc(-c2cn(C(=O)N3CCCCC3Cc3ccccc3)nn2)cc1.Cc1cc(C(=O)N2CCCC2)cc(C)c1-c1ccc(-c2cn(C(=O)N3CCCCC3Cc3ccccc3)nn2)cc1.Cc1cc(C)c(-c2cn(C(=O)N3CCCCC3Cc3ccccc3)nn2)c(C)c1.Cc1cc(C)c(-c2cnn(C(=O)N3CCCCC3Cc3ccccc3)n2)c(C)c1.Cc1ccnc(C)c1-c1ccc(-c2cn(C(=O)N3CCCCC3Cc3ccccc3)nn2)cc1.Cc1ncnc(C)c1-c1ccc(-c2cn(C(=O)N3CCCCC3Cc3ccccc3)nn2)cc1.Cc1ncnc(C)c1-c1ccc(-c2cn(C(=O)N3CCCCC3Cc3ccccc3)nn2)cc1
• InChI: InChI=1S/C34H37N5O2.C32H35N5O2.C28H29N5O.2C27H28N6O.2C24H28N4O/c1-24-20-29(33(40)37-17-8-9-18-37)21-25(2)32(24)28-15-13-27(14-16-28)31-23-39(36-35-31)34(41)38-19-7-6-12-30(38)22-26-10-4-3-5-11-26;1-22-18-27(31(38)35(3)4)19-23(2)30(22)26-15-13-25(14-16-26)29-21-37(34-33-29)32(39)36-17-9-8-12-28(36)20-24-10-6-5-7-11-24;1-20-15-16-29-21(2)27(20)24-13-11-23(12-14-24)26-19-33(31-30-26)28(34)32-17-7-6-10-25(32)18-22-8-4-3-5-9-22;2*1-19-26(20(2)29-18-28-19)23-13-11-22(12-14-23)25-17-33(31-30-25)27(34)32-15-7-6-10-24(32)16-21-8-4-3-5-9-21;1-17-13-18(2)23(19(3)14-17)22-16-28(26-25-22)24(29)27-12-8-7-11-21(27)15-20-9-5-4-6-10-20;1-17-13-18(2)23(19(3)14-17)22-16-25-28(26-22)24(29)27-12-8-7-11-21(27)15-20-9-5-4-6-10-20/h3-5,10-11,13-16,20-21,23,30H,6-9,12,17-19,22H2,1-2H3;5-7,10-11,13-16,18-19,21,28H,8-9,12,17,20H2,1-4H3;3-5,8-9,11-16,19,25H,6-7,10,17-18H2,1-2H3;2*3-5,8-9,11-14,17-18,24H,6-7,10,15-16H2,1-2H3;2*4-6,9-10,13-14,16,21H,7-8,11-12,15H2,1-3H3
• InChIKey: HSHGINJSKKHYPU-UHFFFAOYSA-N
• XLogP: 38.26
• TPSA: 462.21 Ų
• H-Bond Acceptors: 35
• Rotatable Bonds: 28
• Heavy Atoms: 240
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3203.10
LogP ≤ 5	38.26
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	35

Frequently Asked Questions

What is the IUPAC name of [4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-3,5-dimethylphenyl]-pyrrolidin-1-ylmethanone;4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-N,N,3,5-tetramethylbenzamide;(2-benzylpiperidin-1-yl)-[4-[4-(2,4-dimethyl-3-pyridinyl)phenyl]triazol-1-yl]methanone;bis((2-benzylpiperidin-1-yl)-[4-[4-(4,6-dimethylpyrimidin-5-yl)phenyl]triazol-1-yl]methanone);(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-1-yl]methanone;(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-2-yl]methanone?

The IUPAC name of [4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-3,5-dimethylphenyl]-pyrrolidin-1-ylmethanone;4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-N,N,3,5-tetramethylbenzamide;(2-benzylpiperidin-1-yl)-[4-[4-(2,4-dimethyl-3-pyridinyl)phenyl]triazol-1-yl]methanone;bis((2-benzylpiperidin-1-yl)-[4-[4-(4,6-dimethylpyrimidin-5-yl)phenyl]triazol-1-yl]methanone);(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-1-yl]methanone;(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-2-yl]methanone (CID 158572800) is [4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-3,5-dimethylphenyl]-pyrrolidin-1-ylmethanone;4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-N,N,3,5-tetramethylbenzamide;(2-benzylpiperidin-1-yl)-[4-[4-(2,4-dimethyl-3-pyridinyl)phenyl]triazol-1-yl]methanone;bis((2-benzylpiperidin-1-yl)-[4-[4-(4,6-dimethylpyrimidin-5-yl)phenyl]triazol-1-yl]methanone);(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-1-yl]methanone;(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-2-yl]methanone.

What is the SMILES notation for [4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-3,5-dimethylphenyl]-pyrrolidin-1-ylmethanone;4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-N,N,3,5-tetramethylbenzamide;(2-benzylpiperidin-1-yl)-[4-[4-(2,4-dimethyl-3-pyridinyl)phenyl]triazol-1-yl]methanone;bis((2-benzylpiperidin-1-yl)-[4-[4-(4,6-dimethylpyrimidin-5-yl)phenyl]triazol-1-yl]methanone);(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-1-yl]methanone;(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-2-yl]methanone?

The canonical SMILES for [4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-3,5-dimethylphenyl]-pyrrolidin-1-ylmethanone;4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-N,N,3,5-tetramethylbenzamide;(2-benzylpiperidin-1-yl)-[4-[4-(2,4-dimethyl-3-pyridinyl)phenyl]triazol-1-yl]methanone;bis((2-benzylpiperidin-1-yl)-[4-[4-(4,6-dimethylpyrimidin-5-yl)phenyl]triazol-1-yl]methanone);(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-1-yl]methanone;(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-2-yl]methanone is Cc1cc(C(=O)N(C)C)cc(C)c1-c1ccc(-c2cn(C(=O)N3CCCCC3Cc3ccccc3)nn2)cc1.Cc1cc(C(=O)N2CCCC2)cc(C)c1-c1ccc(-c2cn(C(=O)N3CCCCC3Cc3ccccc3)nn2)cc1.Cc1cc(C)c(-c2cn(C(=O)N3CCCCC3Cc3ccccc3)nn2)c(C)c1.Cc1cc(C)c(-c2cnn(C(=O)N3CCCCC3Cc3ccccc3)n2)c(C)c1.Cc1ccnc(C)c1-c1ccc(-c2cn(C(=O)N3CCCCC3Cc3ccccc3)nn2)cc1.Cc1ncnc(C)c1-c1ccc(-c2cn(C(=O)N3CCCCC3Cc3ccccc3)nn2)cc1.Cc1ncnc(C)c1-c1ccc(-c2cn(C(=O)N3CCCCC3Cc3ccccc3)nn2)cc1.

What is the InChIKey of [4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-3,5-dimethylphenyl]-pyrrolidin-1-ylmethanone;4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-N,N,3,5-tetramethylbenzamide;(2-benzylpiperidin-1-yl)-[4-[4-(2,4-dimethyl-3-pyridinyl)phenyl]triazol-1-yl]methanone;bis((2-benzylpiperidin-1-yl)-[4-[4-(4,6-dimethylpyrimidin-5-yl)phenyl]triazol-1-yl]methanone);(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-1-yl]methanone;(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-2-yl]methanone?

The InChIKey is HSHGINJSKKHYPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H37N5O2.C32H35N5O2.C28H29N5O.2C27H28N6O.2C24H28N4O/c1-24-20-29(33(40)37-17-8-9-18-37)21-25(2)32(24)28-15-13-27(14-16-28)31-23-39(36-35-31)34(41)38-19-7-6-12-30(38)22-26-10-4-3-5-11-26;1-22-18-27(31(38)35(3)4)19-23(2)30(22)26-15-13-25(14-16-26)29-21-37(34-33-29)32(39)36-17-9-8-12-28(36)20-24-10-6-5-7-11-24;1-20-15-16-29-21(2)27(20)24-13-11-23(12-14-24)26-19-33(31-30-26)28(34)32-17-7-6-10-25(32)18-22-8-4-3-5-9-22;2*1-19-26(20(2)29-18-28-19)23-13-11-22(12-14-23)25-17-33(31-30-25)27(34)32-15-7-6-10-24(32)16-21-8-4-3-5-9-21;1-17-13-18(2)23(19(3)14-17)22-16-28(26-25-22)24(29)27-12-8-7-11-21(27)15-20-9-5-4-6-10-20;1-17-13-18(2)23(19(3)14-17)22-16-25-28(26-22)24(29)27-12-8-7-11-21(27)15-20-9-5-4-6-10-20/h3-5,10-11,13-16,20-21,23,30H,6-9,12,17-19,22H2,1-2H3;5-7,10-11,13-16,18-19,21,28H,8-9,12,17,20H2,1-4H3;3-5,8-9,11-16,19,25H,6-7,10,17-18H2,1-2H3;2*3-5,8-9,11-14,17-18,24H,6-7,10,15-16H2,1-2H3;2*4-6,9-10,13-14,16,21H,7-8,11-12,15H2,1-3H3.

What are the key properties of [4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-3,5-dimethylphenyl]-pyrrolidin-1-ylmethanone;4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-N,N,3,5-tetramethylbenzamide;(2-benzylpiperidin-1-yl)-[4-[4-(2,4-dimethyl-3-pyridinyl)phenyl]triazol-1-yl]methanone;bis((2-benzylpiperidin-1-yl)-[4-[4-(4,6-dimethylpyrimidin-5-yl)phenyl]triazol-1-yl]methanone);(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-1-yl]methanone;(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-2-yl]methanone?

[4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-3,5-dimethylphenyl]-pyrrolidin-1-ylmethanone;4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-N,N,3,5-tetramethylbenzamide;(2-benzylpiperidin-1-yl)-[4-[4-(2,4-dimethyl-3-pyridinyl)phenyl]triazol-1-yl]methanone;bis((2-benzylpiperidin-1-yl)-[4-[4-(4,6-dimethylpyrimidin-5-yl)phenyl]triazol-1-yl]methanone);(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-1-yl]methanone;(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-2-yl]methanone has a molecular weight of 3203.10 g/mol, XLogP of 38.26, 28 rotatable bonds, 0 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for [4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-3,5-dimethylphenyl]-pyrrolidin-1-ylmethanone;4-[4-[1-(2-benzylpiperidine-1-carbonyl)triazol-4-yl]phenyl]-N,N,3,5-tetramethylbenzamide;(2-benzylpiperidin-1-yl)-[4-[4-(2,4-dimethyl-3-pyridinyl)phenyl]triazol-1-yl]methanone;bis((2-benzylpiperidin-1-yl)-[4-[4-(4,6-dimethylpyrimidin-5-yl)phenyl]triazol-1-yl]methanone);(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-1-yl]methanone;(2-benzylpiperidin-1-yl)-[4-(2,4,6-trimethylphenyl)triazol-2-yl]methanone is sourced from PubChem (CID 158572800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).