bis(1-benzyl-N-[2-(1H-indol-3-yl)ethyl]-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine);1-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;bis(1-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine);bis(N-[2-(1H-indol-3-yl)ethyl]-1-(naphthalen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine)

C195H199F3N12O4 — CID 160749758

About bis(1-benzyl-N-[2-(1H-indol-3-yl)ethyl]-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine);1-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;bis(1-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine);bis(N-[2-(1H-indol-3-yl)ethyl]-1-(naphthalen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine)

bis(1-benzyl-N-[2-(1H-indol-3-yl)ethyl]-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine);1-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;bis(1-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine);bis(N-[2-(1H-indol-3-yl)ethyl]-1-(naphthalen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine) (PubChem CID 160749758) has the molecular formula C195H199F3N12O4 and a molecular weight of 2831.81 g/mol. Its IUPAC name is bis(1-benzyl-N-[2-(1H-indol-3-yl)ethyl]-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine);1-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;bis(1-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine);bis(N-[2-(1H-indol-3-yl)ethyl]-1-(naphthalen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine).

Molecular Properties

• Compound Name: bis(1-benzyl-N-[2-(1H-indol-3-yl)ethyl]-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine);1-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;bis(1-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine);bis(N-[2-(1H-indol-3-yl)ethyl]-1-(naphthalen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine)
• PubChem CID: 160749758
• Molecular Formula: C195H199F3N12O4
• Molecular Weight: 2831.81 g/mol
• Exact Mass: 2829.57
• IUPAC Name: bis(1-benzyl-N-[2-(1H-indol-3-yl)ethyl]-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine);1-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;bis(1-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine);bis(N-[2-(1H-indol-3-yl)ethyl]-1-(naphthalen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine)
• SMILES: COc1ccc2c(c1)C(Cc1ccccc1)C(NCCc1c[nH]c3ccccc13)CC2.COc1ccc2c(c1)C(Cc1ccccc1)C(NCCc1c[nH]c3ccccc13)CC2.COc1ccccc1CNC1CCc2ccccc2C1Cc1ccc(F)cc1.COc1ccccc1CNC1CCc2ccccc2C1Cc1ccc(F)cc1.Fc1ccc(CC2c3ccccc3CCC2NCCc2c[nH]c3ccccc23)cc1.c1ccc2c(c1)CCC(NCCc1c[nH]c3ccccc13)C2Cc1ccc2ccccc2c1.c1ccc2c(c1)CCC(NCCc1c[nH]c3ccccc13)C2Cc1ccc2ccccc2c1
• InChI: InChI=1S/2C31H30N2.2C28H30N2O.C27H27FN2.2C25H26FNO/c2*1-2-9-25-19-22(13-14-23(25)7-1)20-29-27-10-4-3-8-24(27)15-16-31(29)32-18-17-26-21-33-30-12-6-5-11-28(26)30;2*1-31-23-13-11-21-12-14-28(26(25(21)18-23)17-20-7-3-2-4-8-20)29-16-15-22-19-30-27-10-6-5-9-24(22)27;28-22-12-9-19(10-13-22)17-25-23-6-2-1-5-20(23)11-14-27(25)29-16-15-21-18-30-26-8-4-3-7-24(21)26;2*1-28-25-9-5-3-7-20(25)17-27-24-15-12-19-6-2-4-8-22(19)23(24)16-18-10-13-21(26)14-11-18/h2*1-14,19,21,29,31-33H,15-18,20H2;2*2-11,13,18-19,26,28-30H,12,14-17H2,1H3;1-10,12-13,18,25,27,29-30H,11,14-17H2;2*2-11,13-14,23-24,27H,12,15-17H2,1H3
• InChIKey: RWQULWKADYDNND-UHFFFAOYSA-N
• XLogP: 41.20
• TPSA: 200.08 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 11
• Rotatable Bonds: 44
• Heavy Atoms: 214
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2831.81
LogP ≤ 5	41.20
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	11

Frequently Asked Questions

What is the IUPAC name of bis(1-benzyl-N-[2-(1H-indol-3-yl)ethyl]-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine);1-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;bis(1-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine);bis(N-[2-(1H-indol-3-yl)ethyl]-1-(naphthalen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine)?

The IUPAC name of bis(1-benzyl-N-[2-(1H-indol-3-yl)ethyl]-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine);1-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;bis(1-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine);bis(N-[2-(1H-indol-3-yl)ethyl]-1-(naphthalen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine) (CID 160749758) is bis(1-benzyl-N-[2-(1H-indol-3-yl)ethyl]-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine);1-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;bis(1-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine);bis(N-[2-(1H-indol-3-yl)ethyl]-1-(naphthalen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine).

What is the SMILES notation for bis(1-benzyl-N-[2-(1H-indol-3-yl)ethyl]-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine);1-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;bis(1-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine);bis(N-[2-(1H-indol-3-yl)ethyl]-1-(naphthalen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine)?

The canonical SMILES for bis(1-benzyl-N-[2-(1H-indol-3-yl)ethyl]-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine);1-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;bis(1-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine);bis(N-[2-(1H-indol-3-yl)ethyl]-1-(naphthalen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine) is COc1ccc2c(c1)C(Cc1ccccc1)C(NCCc1c[nH]c3ccccc13)CC2.COc1ccc2c(c1)C(Cc1ccccc1)C(NCCc1c[nH]c3ccccc13)CC2.COc1ccccc1CNC1CCc2ccccc2C1Cc1ccc(F)cc1.COc1ccccc1CNC1CCc2ccccc2C1Cc1ccc(F)cc1.Fc1ccc(CC2c3ccccc3CCC2NCCc2c[nH]c3ccccc23)cc1.c1ccc2c(c1)CCC(NCCc1c[nH]c3ccccc13)C2Cc1ccc2ccccc2c1.c1ccc2c(c1)CCC(NCCc1c[nH]c3ccccc13)C2Cc1ccc2ccccc2c1.

What is the InChIKey of bis(1-benzyl-N-[2-(1H-indol-3-yl)ethyl]-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine);1-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;bis(1-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine);bis(N-[2-(1H-indol-3-yl)ethyl]-1-(naphthalen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine)?

The InChIKey is RWQULWKADYDNND-UHFFFAOYSA-N. The full InChI is InChI=1S/2C31H30N2.2C28H30N2O.C27H27FN2.2C25H26FNO/c2*1-2-9-25-19-22(13-14-23(25)7-1)20-29-27-10-4-3-8-24(27)15-16-31(29)32-18-17-26-21-33-30-12-6-5-11-28(26)30;2*1-31-23-13-11-21-12-14-28(26(25(21)18-23)17-20-7-3-2-4-8-20)29-16-15-22-19-30-27-10-6-5-9-24(22)27;28-22-12-9-19(10-13-22)17-25-23-6-2-1-5-20(23)11-14-27(25)29-16-15-21-18-30-26-8-4-3-7-24(21)26;2*1-28-25-9-5-3-7-20(25)17-27-24-15-12-19-6-2-4-8-22(19)23(24)16-18-10-13-21(26)14-11-18/h2*1-14,19,21,29,31-33H,15-18,20H2;2*2-11,13,18-19,26,28-30H,12,14-17H2,1H3;1-10,12-13,18,25,27,29-30H,11,14-17H2;2*2-11,13-14,23-24,27H,12,15-17H2,1H3.

What are the key properties of bis(1-benzyl-N-[2-(1H-indol-3-yl)ethyl]-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine);1-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;bis(1-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine);bis(N-[2-(1H-indol-3-yl)ethyl]-1-(naphthalen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine)?

bis(1-benzyl-N-[2-(1H-indol-3-yl)ethyl]-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine);1-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;bis(1-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine);bis(N-[2-(1H-indol-3-yl)ethyl]-1-(naphthalen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine) has a molecular weight of 2831.81 g/mol, XLogP of 41.20, 44 rotatable bonds, 12 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for bis(1-benzyl-N-[2-(1H-indol-3-yl)ethyl]-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine);1-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;bis(1-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine);bis(N-[2-(1H-indol-3-yl)ethyl]-1-(naphthalen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine) is sourced from PubChem (CID 160749758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).