2-fluoro-N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-6-methylbenzamide;3-fluoro-N-[[7-(3-methoxypropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-5-methylpyridine-4-carboxamide;methane;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-2-methylbenzamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-3-methylpyridine-4-carboxamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-pyridin-4-ylmethyl]-2-methylsulfanylpyridine-3-carboxamide;N-[(7-methyl-7-azabicyclo[2.2.1]heptan-1-yl)-phenylmethyl]-1H-indazole-3-carboxamide;3-methyl-N-[[7-(2-methylpropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]pyridine-4-carboxamide

C164H205F2N21O12S — CID 157285345

About 2-fluoro-N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-6-methylbenzamide;3-fluoro-N-[[7-(3-methoxypropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-5-methylpyridine-4-carboxamide;methane;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-2-methylbenzamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-3-methylpyridine-4-carboxamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-pyridin-4-ylmethyl]-2-methylsulfanylpyridine-3-carboxamide;N-[(7-methyl-7-azabicyclo[2.2.1]heptan-1-yl)-phenylmethyl]-1H-indazole-3-carboxamide;3-methyl-N-[[7-(2-methylpropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]pyridine-4-carboxamide

2-fluoro-N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-6-methylbenzamide;3-fluoro-N-[[7-(3-methoxypropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-5-methylpyridine-4-carboxamide;methane;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-2-methylbenzamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-3-methylpyridine-4-carboxamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-pyridin-4-ylmethyl]-2-methylsulfanylpyridine-3-carboxamide;N-[(7-methyl-7-azabicyclo[2.2.1]heptan-1-yl)-phenylmethyl]-1H-indazole-3-carboxamide;3-methyl-N-[[7-(2-methylpropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]pyridine-4-carboxamide (PubChem CID 157285345) has the molecular formula C164H205F2N21O12S and a molecular weight of 2732.64 g/mol. Its IUPAC name is 2-fluoro-N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-6-methylbenzamide;3-fluoro-N-[[7-(3-methoxypropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-5-methylpyridine-4-carboxamide;methane;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-2-methylbenzamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-3-methylpyridine-4-carboxamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-pyridin-4-ylmethyl]-2-methylsulfanylpyridine-3-carboxamide;N-[(7-methyl-7-azabicyclo[2.2.1]heptan-1-yl)-phenylmethyl]-1H-indazole-3-carboxamide;3-methyl-N-[[7-(2-methylpropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: 2-fluoro-N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-6-methylbenzamide;3-fluoro-N-[[7-(3-methoxypropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-5-methylpyridine-4-carboxamide;methane;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-2-methylbenzamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-3-methylpyridine-4-carboxamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-pyridin-4-ylmethyl]-2-methylsulfanylpyridine-3-carboxamide;N-[(7-methyl-7-azabicyclo[2.2.1]heptan-1-yl)-phenylmethyl]-1H-indazole-3-carboxamide;3-methyl-N-[[7-(2-methylpropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]pyridine-4-carboxamide
• PubChem CID: 157285345
• Molecular Formula: C164H205F2N21O12S
• Molecular Weight: 2732.64 g/mol
• Exact Mass: 2730.58
• IUPAC Name: 2-fluoro-N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-6-methylbenzamide;3-fluoro-N-[[7-(3-methoxypropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-5-methylpyridine-4-carboxamide;methane;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-2-methylbenzamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-3-methylpyridine-4-carboxamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-pyridin-4-ylmethyl]-2-methylsulfanylpyridine-3-carboxamide;N-[(7-methyl-7-azabicyclo[2.2.1]heptan-1-yl)-phenylmethyl]-1H-indazole-3-carboxamide;3-methyl-N-[[7-(2-methylpropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]pyridine-4-carboxamide
• SMILES: C.CN1C2CCC1(C(NC(=O)c1n[nH]c3ccccc13)c1ccccc1)CC2.COCCCN1C2CCC1(C(NC(=O)c1c(C)cncc1F)c1ccccc1)CC2.COCCN1C2CCC1(C(NC(=O)c1c(C)cccc1F)c1ccccc1)CC2.COCCN1C2CCC1(C(NC(=O)c1ccccc1C)c1ccccc1)CC2.COCCN1C2CCC1(C(NC(=O)c1cccnc1SC)c1ccncc1)CC2.COCCN1C2CCC1(C(NC(=O)c1ccncc1C)c1ccccc1)CC2.Cc1cnccc1C(=O)NC(c1ccccc1)C12CCC(CC1)N2CC(C)C
• InChI: InChI=1S/C24H30FN3O2.C24H29FN2O2.C24H31N3O.C24H30N2O2.C23H29N3O2.C22H28N4O2S.C22H24N4O.CH4/c1-17-15-26-16-20(25)21(17)23(29)27-22(18-7-4-3-5-8-18)24-11-9-19(10-12-24)28(24)13-6-14-30-2;1-17-7-6-10-20(25)21(17)23(28)26-22(18-8-4-3-5-9-18)24-13-11-19(12-14-24)27(24)15-16-29-2;1-17(2)16-27-20-9-12-24(27,13-10-20)22(19-7-5-4-6-8-19)26-23(28)21-11-14-25-15-18(21)3;1-18-8-6-7-11-21(18)23(27)25-22(19-9-4-3-5-10-19)24-14-12-20(13-15-24)26(24)16-17-28-2;1-17-16-24-13-10-20(17)22(27)25-21(18-6-4-3-5-7-18)23-11-8-19(9-12-23)26(23)14-15-28-2;1-28-15-14-26-17-5-9-22(26,10-6-17)19(16-7-12-23-13-8-16)25-20(27)18-4-3-11-24-21(18)29-2;1-26-16-11-13-22(26,14-12-16)20(15-7-3-2-4-8-15)23-21(27)19-17-9-5-6-10-18(17)24-25-19;/h3-5,7-8,15-16,19,22H,6,9-14H2,1-2H3,(H,27,29);3-10,19,22H,11-16H2,1-2H3,(H,26,28);4-8,11,14-15,17,20,22H,9-10,12-13,16H2,1-3H3,(H,26,28);3-11,20,22H,12-17H2,1-2H3,(H,25,27);3-7,10,13,16,19,21H,8-9,11-12,14-15H2,1-2H3,(H,25,27);3-4,7-8,11-13,17,19H,5-6,9-10,14-15H2,1-2H3,(H,25,27);2-10,16,20H,11-14H2,1H3,(H,23,27)(H,24,25);1H4
• InChIKey: BADYCQYBRSCXTK-UHFFFAOYSA-N
• XLogP: 28.02
• TPSA: 365.66 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 26
• Rotatable Bonds: 47
• Heavy Atoms: 200
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2732.64
LogP ≤ 5	28.02
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-6-methylbenzamide;3-fluoro-N-[[7-(3-methoxypropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-5-methylpyridine-4-carboxamide;methane;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-2-methylbenzamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-3-methylpyridine-4-carboxamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-pyridin-4-ylmethyl]-2-methylsulfanylpyridine-3-carboxamide;N-[(7-methyl-7-azabicyclo[2.2.1]heptan-1-yl)-phenylmethyl]-1H-indazole-3-carboxamide;3-methyl-N-[[7-(2-methylpropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]pyridine-4-carboxamide?

The IUPAC name of 2-fluoro-N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-6-methylbenzamide;3-fluoro-N-[[7-(3-methoxypropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-5-methylpyridine-4-carboxamide;methane;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-2-methylbenzamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-3-methylpyridine-4-carboxamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-pyridin-4-ylmethyl]-2-methylsulfanylpyridine-3-carboxamide;N-[(7-methyl-7-azabicyclo[2.2.1]heptan-1-yl)-phenylmethyl]-1H-indazole-3-carboxamide;3-methyl-N-[[7-(2-methylpropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]pyridine-4-carboxamide (CID 157285345) is 2-fluoro-N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-6-methylbenzamide;3-fluoro-N-[[7-(3-methoxypropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-5-methylpyridine-4-carboxamide;methane;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-2-methylbenzamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-3-methylpyridine-4-carboxamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-pyridin-4-ylmethyl]-2-methylsulfanylpyridine-3-carboxamide;N-[(7-methyl-7-azabicyclo[2.2.1]heptan-1-yl)-phenylmethyl]-1H-indazole-3-carboxamide;3-methyl-N-[[7-(2-methylpropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]pyridine-4-carboxamide.

What is the SMILES notation for 2-fluoro-N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-6-methylbenzamide;3-fluoro-N-[[7-(3-methoxypropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-5-methylpyridine-4-carboxamide;methane;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-2-methylbenzamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-3-methylpyridine-4-carboxamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-pyridin-4-ylmethyl]-2-methylsulfanylpyridine-3-carboxamide;N-[(7-methyl-7-azabicyclo[2.2.1]heptan-1-yl)-phenylmethyl]-1H-indazole-3-carboxamide;3-methyl-N-[[7-(2-methylpropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]pyridine-4-carboxamide?

The canonical SMILES for 2-fluoro-N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-6-methylbenzamide;3-fluoro-N-[[7-(3-methoxypropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-5-methylpyridine-4-carboxamide;methane;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-2-methylbenzamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-3-methylpyridine-4-carboxamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-pyridin-4-ylmethyl]-2-methylsulfanylpyridine-3-carboxamide;N-[(7-methyl-7-azabicyclo[2.2.1]heptan-1-yl)-phenylmethyl]-1H-indazole-3-carboxamide;3-methyl-N-[[7-(2-methylpropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]pyridine-4-carboxamide is C.CN1C2CCC1(C(NC(=O)c1n[nH]c3ccccc13)c1ccccc1)CC2.COCCCN1C2CCC1(C(NC(=O)c1c(C)cncc1F)c1ccccc1)CC2.COCCN1C2CCC1(C(NC(=O)c1c(C)cccc1F)c1ccccc1)CC2.COCCN1C2CCC1(C(NC(=O)c1ccccc1C)c1ccccc1)CC2.COCCN1C2CCC1(C(NC(=O)c1cccnc1SC)c1ccncc1)CC2.COCCN1C2CCC1(C(NC(=O)c1ccncc1C)c1ccccc1)CC2.Cc1cnccc1C(=O)NC(c1ccccc1)C12CCC(CC1)N2CC(C)C.

What is the InChIKey of 2-fluoro-N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-6-methylbenzamide;3-fluoro-N-[[7-(3-methoxypropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-5-methylpyridine-4-carboxamide;methane;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-2-methylbenzamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-3-methylpyridine-4-carboxamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-pyridin-4-ylmethyl]-2-methylsulfanylpyridine-3-carboxamide;N-[(7-methyl-7-azabicyclo[2.2.1]heptan-1-yl)-phenylmethyl]-1H-indazole-3-carboxamide;3-methyl-N-[[7-(2-methylpropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]pyridine-4-carboxamide?

The InChIKey is BADYCQYBRSCXTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30FN3O2.C24H29FN2O2.C24H31N3O.C24H30N2O2.C23H29N3O2.C22H28N4O2S.C22H24N4O.CH4/c1-17-15-26-16-20(25)21(17)23(29)27-22(18-7-4-3-5-8-18)24-11-9-19(10-12-24)28(24)13-6-14-30-2;1-17-7-6-10-20(25)21(17)23(28)26-22(18-8-4-3-5-9-18)24-13-11-19(12-14-24)27(24)15-16-29-2;1-17(2)16-27-20-9-12-24(27,13-10-20)22(19-7-5-4-6-8-19)26-23(28)21-11-14-25-15-18(21)3;1-18-8-6-7-11-21(18)23(27)25-22(19-9-4-3-5-10-19)24-14-12-20(13-15-24)26(24)16-17-28-2;1-17-16-24-13-10-20(17)22(27)25-21(18-6-4-3-5-7-18)23-11-8-19(9-12-23)26(23)14-15-28-2;1-28-15-14-26-17-5-9-22(26,10-6-17)19(16-7-12-23-13-8-16)25-20(27)18-4-3-11-24-21(18)29-2;1-26-16-11-13-22(26,14-12-16)20(15-7-3-2-4-8-15)23-21(27)19-17-9-5-6-10-18(17)24-25-19;/h3-5,7-8,15-16,19,22H,6,9-14H2,1-2H3,(H,27,29);3-10,19,22H,11-16H2,1-2H3,(H,26,28);4-8,11,14-15,17,20,22H,9-10,12-13,16H2,1-3H3,(H,26,28);3-11,20,22H,12-17H2,1-2H3,(H,25,27);3-7,10,13,16,19,21H,8-9,11-12,14-15H2,1-2H3,(H,25,27);3-4,7-8,11-13,17,19H,5-6,9-10,14-15H2,1-2H3,(H,25,27);2-10,16,20H,11-14H2,1H3,(H,23,27)(H,24,25);1H4.

What are the key properties of 2-fluoro-N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-6-methylbenzamide;3-fluoro-N-[[7-(3-methoxypropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-5-methylpyridine-4-carboxamide;methane;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-2-methylbenzamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-3-methylpyridine-4-carboxamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-pyridin-4-ylmethyl]-2-methylsulfanylpyridine-3-carboxamide;N-[(7-methyl-7-azabicyclo[2.2.1]heptan-1-yl)-phenylmethyl]-1H-indazole-3-carboxamide;3-methyl-N-[[7-(2-methylpropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]pyridine-4-carboxamide?

2-fluoro-N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-6-methylbenzamide;3-fluoro-N-[[7-(3-methoxypropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-5-methylpyridine-4-carboxamide;methane;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-2-methylbenzamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-3-methylpyridine-4-carboxamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-pyridin-4-ylmethyl]-2-methylsulfanylpyridine-3-carboxamide;N-[(7-methyl-7-azabicyclo[2.2.1]heptan-1-yl)-phenylmethyl]-1H-indazole-3-carboxamide;3-methyl-N-[[7-(2-methylpropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]pyridine-4-carboxamide has a molecular weight of 2732.64 g/mol, XLogP of 28.02, 47 rotatable bonds, 8 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 2-fluoro-N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-6-methylbenzamide;3-fluoro-N-[[7-(3-methoxypropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-5-methylpyridine-4-carboxamide;methane;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-2-methylbenzamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]-3-methylpyridine-4-carboxamide;N-[[7-(2-methoxyethyl)-7-azabicyclo[2.2.1]heptan-1-yl]-pyridin-4-ylmethyl]-2-methylsulfanylpyridine-3-carboxamide;N-[(7-methyl-7-azabicyclo[2.2.1]heptan-1-yl)-phenylmethyl]-1H-indazole-3-carboxamide;3-methyl-N-[[7-(2-methylpropyl)-7-azabicyclo[2.2.1]heptan-1-yl]-phenylmethyl]pyridine-4-carboxamide is sourced from PubChem (CID 157285345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).