4-(1-benzofuran-5-ylsulfonyl)-2,2-dimethyl-N-(2-methylpropyl)butan-1-amine;N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-(7,7-dimethyl-5-oxooctyl)-N-(2-methylpropyl)-1-benzofuran-5-sulfonamide

C149H214N18O23S6 — CID 161144210

About 4-(1-benzofuran-5-ylsulfonyl)-2,2-dimethyl-N-(2-methylpropyl)butan-1-amine;N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-(7,7-dimethyl-5-oxooctyl)-N-(2-methylpropyl)-1-benzofuran-5-sulfonamide

4-(1-benzofuran-5-ylsulfonyl)-2,2-dimethyl-N-(2-methylpropyl)butan-1-amine;N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-(7,7-dimethyl-5-oxooctyl)-N-(2-methylpropyl)-1-benzofuran-5-sulfonamide (PubChem CID 161144210) has the molecular formula C149H214N18O23S6 and a molecular weight of 2817.86 g/mol. Its IUPAC name is 4-(1-benzofuran-5-ylsulfonyl)-2,2-dimethyl-N-(2-methylpropyl)butan-1-amine;N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-(7,7-dimethyl-5-oxooctyl)-N-(2-methylpropyl)-1-benzofuran-5-sulfonamide.

Molecular Properties

• Compound Name: 4-(1-benzofuran-5-ylsulfonyl)-2,2-dimethyl-N-(2-methylpropyl)butan-1-amine;N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-(7,7-dimethyl-5-oxooctyl)-N-(2-methylpropyl)-1-benzofuran-5-sulfonamide
• PubChem CID: 161144210
• Molecular Formula: C149H214N18O23S6
• Molecular Weight: 2817.86 g/mol
• Exact Mass: 2815.45
• IUPAC Name: 4-(1-benzofuran-5-ylsulfonyl)-2,2-dimethyl-N-(2-methylpropyl)butan-1-amine;N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-(7,7-dimethyl-5-oxooctyl)-N-(2-methylpropyl)-1-benzofuran-5-sulfonamide
• SMILES: CC(C)CN(CC(C)(C)CN(CCn1ccnc1)S(=O)(=O)c1ccc2occc2c1)C(=O)CC(C)(C)C.CC(C)CN(CCCCC(=O)CC(C)(C)C)S(=O)(=O)c1ccc2occc2c1.CC(C)CN(CCCN(CCn1cncn1)S(=O)(=O)c1ccc2occc2c1)C(=O)CC(C)(C)C.CC(C)CN(CCCN(Cc1ccc2nccn2c1)S(=O)(=O)c1ccc2occc2c1)C(=O)CC(C)(C)C.CC(C)CN(CCCN(Cc1ccccn1)S(=O)(=O)c1ccc2occc2c1)C(=O)CC(C)(C)C.CC(C)CNCC(C)(C)CCS(=O)(=O)c1ccc2occc2c1
• InChI: InChI=1S/C29H38N4O4S.C28H42N4O4S.C27H37N3O4S.C25H37N5O4S.C22H33NO4S.C18H27NO3S/c1-22(2)19-32(28(34)18-29(3,4)5)13-6-14-33(21-23-7-10-27-30-12-15-31(27)20-23)38(35,36)25-8-9-26-24(17-25)11-16-37-26;1-22(2)18-31(26(33)17-27(3,4)5)19-28(6,7)20-32(14-13-30-12-11-29-21-30)37(34,35)24-8-9-25-23(16-24)10-15-36-25;1-21(2)19-29(26(31)18-27(3,4)5)14-8-15-30(20-23-9-6-7-13-28-23)35(32,33)24-10-11-25-22(17-24)12-16-34-25;1-20(2)17-28(24(31)16-25(3,4)5)10-6-11-30(13-12-29-19-26-18-27-29)35(32,33)22-7-8-23-21(15-22)9-14-34-23;1-17(2)16-23(12-7-6-8-19(24)15-22(3,4)5)28(25,26)20-9-10-21-18(14-20)11-13-27-21;1-14(2)12-19-13-18(3,4)8-10-23(20,21)16-5-6-17-15(11-16)7-9-22-17/h7-12,15-17,20,22H,6,13-14,18-19,21H2,1-5H3;8-12,15-16,21-22H,13-14,17-20H2,1-7H3;6-7,9-13,16-17,21H,8,14-15,18-20H2,1-5H3;7-9,14-15,18-20H,6,10-13,16-17H2,1-5H3;9-11,13-14,17H,6-8,12,15-16H2,1-5H3;5-7,9,11,14,19H,8,10,12-13H2,1-4H3
• InChIKey: UNVKRTPOIYBDAY-UHFFFAOYSA-N
• XLogP: 29.33
• TPSA: 488.94 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 32
• Rotatable Bonds: 64
• Heavy Atoms: 196
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2817.86
LogP ≤ 5	29.33
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-(1-benzofuran-5-ylsulfonyl)-2,2-dimethyl-N-(2-methylpropyl)butan-1-amine;N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-(7,7-dimethyl-5-oxooctyl)-N-(2-methylpropyl)-1-benzofuran-5-sulfonamide?

The IUPAC name of 4-(1-benzofuran-5-ylsulfonyl)-2,2-dimethyl-N-(2-methylpropyl)butan-1-amine;N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-(7,7-dimethyl-5-oxooctyl)-N-(2-methylpropyl)-1-benzofuran-5-sulfonamide (CID 161144210) is 4-(1-benzofuran-5-ylsulfonyl)-2,2-dimethyl-N-(2-methylpropyl)butan-1-amine;N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-(7,7-dimethyl-5-oxooctyl)-N-(2-methylpropyl)-1-benzofuran-5-sulfonamide.

What is the SMILES notation for 4-(1-benzofuran-5-ylsulfonyl)-2,2-dimethyl-N-(2-methylpropyl)butan-1-amine;N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-(7,7-dimethyl-5-oxooctyl)-N-(2-methylpropyl)-1-benzofuran-5-sulfonamide?

The canonical SMILES for 4-(1-benzofuran-5-ylsulfonyl)-2,2-dimethyl-N-(2-methylpropyl)butan-1-amine;N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-(7,7-dimethyl-5-oxooctyl)-N-(2-methylpropyl)-1-benzofuran-5-sulfonamide is CC(C)CN(CC(C)(C)CN(CCn1ccnc1)S(=O)(=O)c1ccc2occc2c1)C(=O)CC(C)(C)C.CC(C)CN(CCCCC(=O)CC(C)(C)C)S(=O)(=O)c1ccc2occc2c1.CC(C)CN(CCCN(CCn1cncn1)S(=O)(=O)c1ccc2occc2c1)C(=O)CC(C)(C)C.CC(C)CN(CCCN(Cc1ccc2nccn2c1)S(=O)(=O)c1ccc2occc2c1)C(=O)CC(C)(C)C.CC(C)CN(CCCN(Cc1ccccn1)S(=O)(=O)c1ccc2occc2c1)C(=O)CC(C)(C)C.CC(C)CNCC(C)(C)CCS(=O)(=O)c1ccc2occc2c1.

What is the InChIKey of 4-(1-benzofuran-5-ylsulfonyl)-2,2-dimethyl-N-(2-methylpropyl)butan-1-amine;N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-(7,7-dimethyl-5-oxooctyl)-N-(2-methylpropyl)-1-benzofuran-5-sulfonamide?

The InChIKey is UNVKRTPOIYBDAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H38N4O4S.C28H42N4O4S.C27H37N3O4S.C25H37N5O4S.C22H33NO4S.C18H27NO3S/c1-22(2)19-32(28(34)18-29(3,4)5)13-6-14-33(21-23-7-10-27-30-12-15-31(27)20-23)38(35,36)25-8-9-26-24(17-25)11-16-37-26;1-22(2)18-31(26(33)17-27(3,4)5)19-28(6,7)20-32(14-13-30-12-11-29-21-30)37(34,35)24-8-9-25-23(16-24)10-15-36-25;1-21(2)19-29(26(31)18-27(3,4)5)14-8-15-30(20-23-9-6-7-13-28-23)35(32,33)24-10-11-25-22(17-24)12-16-34-25;1-20(2)17-28(24(31)16-25(3,4)5)10-6-11-30(13-12-29-19-26-18-27-29)35(32,33)22-7-8-23-21(15-22)9-14-34-23;1-17(2)16-23(12-7-6-8-19(24)15-22(3,4)5)28(25,26)20-9-10-21-18(14-20)11-13-27-21;1-14(2)12-19-13-18(3,4)8-10-23(20,21)16-5-6-17-15(11-16)7-9-22-17/h7-12,15-17,20,22H,6,13-14,18-19,21H2,1-5H3;8-12,15-16,21-22H,13-14,17-20H2,1-7H3;6-7,9-13,16-17,21H,8,14-15,18-20H2,1-5H3;7-9,14-15,18-20H,6,10-13,16-17H2,1-5H3;9-11,13-14,17H,6-8,12,15-16H2,1-5H3;5-7,9,11,14,19H,8,10,12-13H2,1-4H3.

What are the key properties of 4-(1-benzofuran-5-ylsulfonyl)-2,2-dimethyl-N-(2-methylpropyl)butan-1-amine;N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-(7,7-dimethyl-5-oxooctyl)-N-(2-methylpropyl)-1-benzofuran-5-sulfonamide?

4-(1-benzofuran-5-ylsulfonyl)-2,2-dimethyl-N-(2-methylpropyl)butan-1-amine;N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-(7,7-dimethyl-5-oxooctyl)-N-(2-methylpropyl)-1-benzofuran-5-sulfonamide has a molecular weight of 2817.86 g/mol, XLogP of 29.33, 64 rotatable bonds, 1 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(1-benzofuran-5-ylsulfonyl)-2,2-dimethyl-N-(2-methylpropyl)butan-1-amine;N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-(7,7-dimethyl-5-oxooctyl)-N-(2-methylpropyl)-1-benzofuran-5-sulfonamide is sourced from PubChem (CID 161144210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).