3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methoxy-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methyl-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-(2-pyridin-2-ylethyl)bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-[[4-(trifluoromethyl)phenyl]methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-[(2,5-dimethylpyrazol-3-yl)methyl]bicyclo[1.1.1]pentane-1-carboxamide

C107H110Cl6F5N15O16 — CID 159834982

About 3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methoxy-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methyl-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-(2-pyridin-2-ylethyl)bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-[[4-(trifluoromethyl)phenyl]methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-[(2,5-dimethylpyrazol-3-yl)methyl]bicyclo[1.1.1]pentane-1-carboxamide

3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methoxy-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methyl-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-(2-pyridin-2-ylethyl)bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-[[4-(trifluoromethyl)phenyl]methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-[(2,5-dimethylpyrazol-3-yl)methyl]bicyclo[1.1.1]pentane-1-carboxamide (PubChem CID 159834982) has the molecular formula C107H110Cl6F5N15O16 and a molecular weight of 2169.85 g/mol. Its IUPAC name is 3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methoxy-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methyl-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-(2-pyridin-2-ylethyl)bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-[[4-(trifluoromethyl)phenyl]methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-[(2,5-dimethylpyrazol-3-yl)methyl]bicyclo[1.1.1]pentane-1-carboxamide.

Molecular Properties

• Compound Name: 3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methoxy-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methyl-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-(2-pyridin-2-ylethyl)bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-[[4-(trifluoromethyl)phenyl]methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-[(2,5-dimethylpyrazol-3-yl)methyl]bicyclo[1.1.1]pentane-1-carboxamide
• PubChem CID: 159834982
• Molecular Formula: C107H110Cl6F5N15O16
• Molecular Weight: 2169.85 g/mol
• Exact Mass: 2165.63
• IUPAC Name: 3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methoxy-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methyl-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-(2-pyridin-2-ylethyl)bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-[[4-(trifluoromethyl)phenyl]methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-[(2,5-dimethylpyrazol-3-yl)methyl]bicyclo[1.1.1]pentane-1-carboxamide
• SMILES: COc1ccc(CNC(=O)C23CC(NC(=O)COc4ccc(Cl)c(F)c4)(C2)C3)cn1.Cc1cc(CNC(=O)C23CC(NC(=O)COc4ccc(Cl)c(Cl)c4)(C2)C3)n(C)n1.Cc1cc(OCC(=O)NC23CC(C(=O)NCCc4ccccn4)(C2)C3)ccc1Cl.Cc1cc(OCC(=O)NC23CC(C(=O)NCc4ccc(C(F)(F)F)cc4)(C2)C3)ccc1Cl.Cc1ccc(CNC(=O)C23CC(NC(=O)COc4ccc(Cl)c(F)c4)(C2)C3)cn1
• InChI: InChI=1S/C23H22ClF3N2O3.C22H24ClN3O3.C21H21ClFN3O4.C21H21ClFN3O3.C20H22Cl2N4O3/c1-14-8-17(6-7-18(14)24)32-10-19(30)29-22-11-21(12-22,13-22)20(31)28-9-15-2-4-16(5-3-15)23(25,26)27;1-15-10-17(5-6-18(15)23)29-11-19(27)26-22-12-21(13-22,14-22)20(28)25-9-7-16-4-2-3-8-24-16;1-29-18-5-2-13(7-24-18)8-25-19(28)20-10-21(11-20,12-20)26-17(27)9-30-14-3-4-15(22)16(23)6-14;1-13-2-3-14(7-24-13)8-25-19(28)20-10-21(11-20,12-20)26-18(27)9-29-15-4-5-16(22)17(23)6-15;1-12-5-13(26(2)25-12)7-23-18(28)19-9-20(10-19,11-19)24-17(27)8-29-14-3-4-15(21)16(22)6-14/h2-8H,9-13H2,1H3,(H,28,31)(H,29,30);2-6,8,10H,7,9,11-14H2,1H3,(H,25,28)(H,26,27);2-7H,8-12H2,1H3,(H,25,28)(H,26,27);2-7H,8-12H2,1H3,(H,25,28)(H,26,27);3-6H,7-11H2,1-2H3,(H,23,28)(H,24,27)
• InChIKey: NNYHNLBAPBLVNT-UHFFFAOYSA-N
• XLogP: 15.52
• TPSA: 402.87 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 21
• Rotatable Bonds: 37
• Heavy Atoms: 149
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2169.85
LogP ≤ 5	15.52
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methoxy-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methyl-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-(2-pyridin-2-ylethyl)bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-[[4-(trifluoromethyl)phenyl]methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-[(2,5-dimethylpyrazol-3-yl)methyl]bicyclo[1.1.1]pentane-1-carboxamide?

The IUPAC name of 3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methoxy-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methyl-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-(2-pyridin-2-ylethyl)bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-[[4-(trifluoromethyl)phenyl]methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-[(2,5-dimethylpyrazol-3-yl)methyl]bicyclo[1.1.1]pentane-1-carboxamide (CID 159834982) is 3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methoxy-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methyl-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-(2-pyridin-2-ylethyl)bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-[[4-(trifluoromethyl)phenyl]methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-[(2,5-dimethylpyrazol-3-yl)methyl]bicyclo[1.1.1]pentane-1-carboxamide.

What is the SMILES notation for 3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methoxy-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methyl-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-(2-pyridin-2-ylethyl)bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-[[4-(trifluoromethyl)phenyl]methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-[(2,5-dimethylpyrazol-3-yl)methyl]bicyclo[1.1.1]pentane-1-carboxamide?

The canonical SMILES for 3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methoxy-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methyl-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-(2-pyridin-2-ylethyl)bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-[[4-(trifluoromethyl)phenyl]methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-[(2,5-dimethylpyrazol-3-yl)methyl]bicyclo[1.1.1]pentane-1-carboxamide is COc1ccc(CNC(=O)C23CC(NC(=O)COc4ccc(Cl)c(F)c4)(C2)C3)cn1.Cc1cc(CNC(=O)C23CC(NC(=O)COc4ccc(Cl)c(Cl)c4)(C2)C3)n(C)n1.Cc1cc(OCC(=O)NC23CC(C(=O)NCCc4ccccn4)(C2)C3)ccc1Cl.Cc1cc(OCC(=O)NC23CC(C(=O)NCc4ccc(C(F)(F)F)cc4)(C2)C3)ccc1Cl.Cc1ccc(CNC(=O)C23CC(NC(=O)COc4ccc(Cl)c(F)c4)(C2)C3)cn1.

What is the InChIKey of 3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methoxy-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methyl-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-(2-pyridin-2-ylethyl)bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-[[4-(trifluoromethyl)phenyl]methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-[(2,5-dimethylpyrazol-3-yl)methyl]bicyclo[1.1.1]pentane-1-carboxamide?

The InChIKey is NNYHNLBAPBLVNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22ClF3N2O3.C22H24ClN3O3.C21H21ClFN3O4.C21H21ClFN3O3.C20H22Cl2N4O3/c1-14-8-17(6-7-18(14)24)32-10-19(30)29-22-11-21(12-22,13-22)20(31)28-9-15-2-4-16(5-3-15)23(25,26)27;1-15-10-17(5-6-18(15)23)29-11-19(27)26-22-12-21(13-22,14-22)20(28)25-9-7-16-4-2-3-8-24-16;1-29-18-5-2-13(7-24-18)8-25-19(28)20-10-21(11-20,12-20)26-17(27)9-30-14-3-4-15(22)16(23)6-14;1-13-2-3-14(7-24-13)8-25-19(28)20-10-21(11-20,12-20)26-18(27)9-29-15-4-5-16(22)17(23)6-15;1-12-5-13(26(2)25-12)7-23-18(28)19-9-20(10-19,11-19)24-17(27)8-29-14-3-4-15(21)16(22)6-14/h2-8H,9-13H2,1H3,(H,28,31)(H,29,30);2-6,8,10H,7,9,11-14H2,1H3,(H,25,28)(H,26,27);2-7H,8-12H2,1H3,(H,25,28)(H,26,27);2-7H,8-12H2,1H3,(H,25,28)(H,26,27);3-6H,7-11H2,1-2H3,(H,23,28)(H,24,27).

What are the key properties of 3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methoxy-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methyl-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-(2-pyridin-2-ylethyl)bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-[[4-(trifluoromethyl)phenyl]methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-[(2,5-dimethylpyrazol-3-yl)methyl]bicyclo[1.1.1]pentane-1-carboxamide?

3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methoxy-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methyl-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-(2-pyridin-2-ylethyl)bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-[[4-(trifluoromethyl)phenyl]methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-[(2,5-dimethylpyrazol-3-yl)methyl]bicyclo[1.1.1]pentane-1-carboxamide has a molecular weight of 2169.85 g/mol, XLogP of 15.52, 37 rotatable bonds, 10 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methoxy-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-N-[(6-methyl-3-pyridinyl)methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-(2-pyridin-2-ylethyl)bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-[[4-(trifluoromethyl)phenyl]methyl]bicyclo[1.1.1]pentane-1-carboxamide;3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-[(2,5-dimethylpyrazol-3-yl)methyl]bicyclo[1.1.1]pentane-1-carboxamide is sourced from PubChem (CID 159834982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).