N-(3,4-difluorophenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methoxy-6,7,8,9-tetrahydro-5H-carbazol-2-amine;6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3,4-dimethoxyphenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(3,4-dimethoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine;N-(4-fluoro-3-methoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine

C129H142F5N13O15 — CID 157457643

About N-(3,4-difluorophenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methoxy-6,7,8,9-tetrahydro-5H-carbazol-2-amine;6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3,4-dimethoxyphenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(3,4-dimethoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine;N-(4-fluoro-3-methoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine

N-(3,4-difluorophenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methoxy-6,7,8,9-tetrahydro-5H-carbazol-2-amine;6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3,4-dimethoxyphenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(3,4-dimethoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine;N-(4-fluoro-3-methoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine (PubChem CID 157457643) has the molecular formula C129H142F5N13O15 and a molecular weight of 2209.62 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methoxy-6,7,8,9-tetrahydro-5H-carbazol-2-amine;6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3,4-dimethoxyphenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(3,4-dimethoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine;N-(4-fluoro-3-methoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine.

Molecular Properties

• Compound Name: N-(3,4-difluorophenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methoxy-6,7,8,9-tetrahydro-5H-carbazol-2-amine;6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3,4-dimethoxyphenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(3,4-dimethoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine;N-(4-fluoro-3-methoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine
• PubChem CID: 157457643
• Molecular Formula: C129H142F5N13O15
• Molecular Weight: 2209.62 g/mol
• Exact Mass: 2208.07
• IUPAC Name: N-(3,4-difluorophenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methoxy-6,7,8,9-tetrahydro-5H-carbazol-2-amine;6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3,4-dimethoxyphenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(3,4-dimethoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine;N-(4-fluoro-3-methoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine
• SMILES: COC1CCc2[nH]c3cc(Nc4ccc5c(c4)OCCO5)ccc3c2C1.COC1CCc2c(c3cc(Cc4ccc5c(c4)OCCO5)ccc3n2C)C1.COc1cc(Nc2ccc3c4c(n(C)c3c2)CCC(OC)C4)ccc1F.COc1ccc(Nc2ccc3c4c(n(C)c3c2)CCC(OC)C4)cc1OC.COc1ccc(Nc2ccc3c4c(n(C)c3n2)CCC(OCCF)C4)cc1OC.Cn1c2c(c3ccc(Nc4ccc(F)c(F)c4)nc31)CC(OCCF)CC2
• InChI: InChI=1S/C23H25NO3.C22H26FN3O3.C22H26N2O3.C21H23FN2O2.C21H22N2O3.C20H20F3N3O/c1-24-20-6-3-15(11-16-4-8-22-23(13-16)27-10-9-26-22)12-18(20)19-14-17(25-2)5-7-21(19)24;1-26-18-7-5-15(29-11-10-23)13-17(18)16-6-9-21(25-22(16)26)24-14-4-8-19(27-2)20(12-14)28-3;1-24-19-9-7-16(25-2)13-18(19)17-8-5-14(11-20(17)24)23-15-6-10-21(26-3)22(12-15)27-4;1-24-19-9-6-15(25-2)12-17(19)16-7-4-13(10-20(16)24)23-14-5-8-18(22)21(11-14)26-3;1-24-15-4-6-18-17(12-15)16-5-2-13(10-19(16)23-18)22-14-3-7-20-21(11-14)26-9-8-25-20;1-26-18-6-3-13(27-9-8-21)11-15(18)14-4-7-19(25-20(14)26)24-12-2-5-16(22)17(23)10-12/h3-4,6,8,12-13,17H,5,7,9-11,14H2,1-2H3;4,6,8-9,12,15H,5,7,10-11,13H2,1-3H3,(H,24,25);5-6,8,10-12,16,23H,7,9,13H2,1-4H3;4-5,7-8,10-11,15,23H,6,9,12H2,1-3H3;2-3,5,7,10-11,15,22-23H,4,6,8-9,12H2,1H3;2,4-5,7,10,13H,3,6,8-9,11H2,1H3,(H,24,25)
• InChIKey: BTNYOQADWZSGON-UHFFFAOYSA-N
• XLogP: 25.86
• TPSA: 264.82 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 27
• Rotatable Bonds: 27
• Heavy Atoms: 162
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2209.62
LogP ≤ 5	25.86
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methoxy-6,7,8,9-tetrahydro-5H-carbazol-2-amine;6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3,4-dimethoxyphenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(3,4-dimethoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine;N-(4-fluoro-3-methoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine?

The IUPAC name of N-(3,4-difluorophenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methoxy-6,7,8,9-tetrahydro-5H-carbazol-2-amine;6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3,4-dimethoxyphenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(3,4-dimethoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine;N-(4-fluoro-3-methoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine (CID 157457643) is N-(3,4-difluorophenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methoxy-6,7,8,9-tetrahydro-5H-carbazol-2-amine;6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3,4-dimethoxyphenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(3,4-dimethoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine;N-(4-fluoro-3-methoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine.

What is the SMILES notation for N-(3,4-difluorophenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methoxy-6,7,8,9-tetrahydro-5H-carbazol-2-amine;6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3,4-dimethoxyphenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(3,4-dimethoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine;N-(4-fluoro-3-methoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine?

The canonical SMILES for N-(3,4-difluorophenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methoxy-6,7,8,9-tetrahydro-5H-carbazol-2-amine;6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3,4-dimethoxyphenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(3,4-dimethoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine;N-(4-fluoro-3-methoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine is COC1CCc2[nH]c3cc(Nc4ccc5c(c4)OCCO5)ccc3c2C1.COC1CCc2c(c3cc(Cc4ccc5c(c4)OCCO5)ccc3n2C)C1.COc1cc(Nc2ccc3c4c(n(C)c3c2)CCC(OC)C4)ccc1F.COc1ccc(Nc2ccc3c4c(n(C)c3c2)CCC(OC)C4)cc1OC.COc1ccc(Nc2ccc3c4c(n(C)c3n2)CCC(OCCF)C4)cc1OC.Cn1c2c(c3ccc(Nc4ccc(F)c(F)c4)nc31)CC(OCCF)CC2.

What is the InChIKey of N-(3,4-difluorophenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methoxy-6,7,8,9-tetrahydro-5H-carbazol-2-amine;6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3,4-dimethoxyphenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(3,4-dimethoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine;N-(4-fluoro-3-methoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine?

The InChIKey is BTNYOQADWZSGON-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO3.C22H26FN3O3.C22H26N2O3.C21H23FN2O2.C21H22N2O3.C20H20F3N3O/c1-24-20-6-3-15(11-16-4-8-22-23(13-16)27-10-9-26-22)12-18(20)19-14-17(25-2)5-7-21(19)24;1-26-18-7-5-15(29-11-10-23)13-17(18)16-6-9-21(25-22(16)26)24-14-4-8-19(27-2)20(12-14)28-3;1-24-19-9-7-16(25-2)13-18(19)17-8-5-14(11-20(17)24)23-15-6-10-21(26-3)22(12-15)27-4;1-24-19-9-6-15(25-2)12-17(19)16-7-4-13(10-20(16)24)23-14-5-8-18(22)21(11-14)26-3;1-24-15-4-6-18-17(12-15)16-5-2-13(10-19(16)23-18)22-14-3-7-20-21(11-14)26-9-8-25-20;1-26-18-6-3-13(27-9-8-21)11-15(18)14-4-7-19(25-20(14)26)24-12-2-5-16(22)17(23)10-12/h3-4,6,8,12-13,17H,5,7,9-11,14H2,1-2H3;4,6,8-9,12,15H,5,7,10-11,13H2,1-3H3,(H,24,25);5-6,8,10-12,16,23H,7,9,13H2,1-4H3;4-5,7-8,10-11,15,23H,6,9,12H2,1-3H3;2-3,5,7,10-11,15,22-23H,4,6,8-9,12H2,1H3;2,4-5,7,10,13H,3,6,8-9,11H2,1H3,(H,24,25).

What are the key properties of N-(3,4-difluorophenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methoxy-6,7,8,9-tetrahydro-5H-carbazol-2-amine;6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3,4-dimethoxyphenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(3,4-dimethoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine;N-(4-fluoro-3-methoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine?

N-(3,4-difluorophenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methoxy-6,7,8,9-tetrahydro-5H-carbazol-2-amine;6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3,4-dimethoxyphenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(3,4-dimethoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine;N-(4-fluoro-3-methoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine has a molecular weight of 2209.62 g/mol, XLogP of 25.86, 27 rotatable bonds, 6 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for N-(3,4-difluorophenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methoxy-6,7,8,9-tetrahydro-5H-carbazol-2-amine;6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3,4-dimethoxyphenyl)-6-(2-fluoroethoxy)-9-methyl-5,6,7,8-tetrahydropyrido[2,3-b]indol-2-amine;N-(3,4-dimethoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine;N-(4-fluoro-3-methoxyphenyl)-6-methoxy-9-methyl-5,6,7,8-tetrahydrocarbazol-2-amine is sourced from PubChem (CID 157457643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).