N-[2-[6-(difluoromethyl)-3-pyridinyl]-5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-3-formyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methylmethanamine

C68H57F7N10O9S2 — CID 144681501

About N-[2-[6-(difluoromethyl)-3-pyridinyl]-5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-3-formyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methylmethanamine

N-[2-[6-(difluoromethyl)-3-pyridinyl]-5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-3-formyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methylmethanamine (PubChem CID 144681501) has the molecular formula C68H57F7N10O9S2 and a molecular weight of 1355.38 g/mol. Its IUPAC name is N-[2-[6-(difluoromethyl)-3-pyridinyl]-5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-3-formyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methylmethanamine.

Molecular Properties

• Compound Name: N-[2-[6-(difluoromethyl)-3-pyridinyl]-5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-3-formyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methylmethanamine
• PubChem CID: 144681501
• Molecular Formula: C68H57F7N10O9S2
• Molecular Weight: 1355.38 g/mol
• Exact Mass: 1354.36
• IUPAC Name: N-[2-[6-(difluoromethyl)-3-pyridinyl]-5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-3-formyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methylmethanamine
• SMILES: CN(c1cc2oc(-c3ccc(C(F)F)nc3)c(C=O)c2cc1-c1ccc2c(n1)-c1cc3c(F)cccc3n1CC2)S(C)(=O)=O.CNC.CNC(=O)c1c(-c2ccc(OCC(F)(F)F)nc2)oc2cc(N(C)S(C)(=O)=O)c(-c3ccc4c(n3)-c3cc5c(F)cccc5n3CC4)cc12
• InChI: InChI=1S/C34H27F4N5O5S.C32H23F3N4O4S.C2H7N/c1-39-33(44)30-22-13-21(24-9-7-18-11-12-43-25-6-4-5-23(35)20(25)14-27(43)31(18)41-24)26(42(2)49(3,45)46)15-28(22)48-32(30)19-8-10-29(40-16-19)47-17-34(36,37)38;1-38(44(2,41)42)27-14-29-19(22(16-40)31(43-29)18-7-9-25(32(34)35)36-15-18)12-21(27)24-8-6-17-10-11-39-26-5-3-4-23(33)20(26)13-28(39)30(17)37-24;1-3-2/h4-10,13-16H,11-12,17H2,1-3H3,(H,39,44);3-9,12-16,32H,10-11H2,1-2H3;3H,1-2H3
• InChIKey: UVPZDLMWTSGTNC-UHFFFAOYSA-N
• XLogP: 13.43
• TPSA: 229.89 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 16
• Rotatable Bonds: 13
• Heavy Atoms: 96
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1355.38
LogP ≤ 5	13.43
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[2-[6-(difluoromethyl)-3-pyridinyl]-5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-3-formyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methylmethanamine?

The IUPAC name of N-[2-[6-(difluoromethyl)-3-pyridinyl]-5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-3-formyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methylmethanamine (CID 144681501) is N-[2-[6-(difluoromethyl)-3-pyridinyl]-5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-3-formyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methylmethanamine.

What is the SMILES notation for N-[2-[6-(difluoromethyl)-3-pyridinyl]-5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-3-formyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methylmethanamine?

The canonical SMILES for N-[2-[6-(difluoromethyl)-3-pyridinyl]-5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-3-formyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methylmethanamine is CN(c1cc2oc(-c3ccc(C(F)F)nc3)c(C=O)c2cc1-c1ccc2c(n1)-c1cc3c(F)cccc3n1CC2)S(C)(=O)=O.CNC.CNC(=O)c1c(-c2ccc(OCC(F)(F)F)nc2)oc2cc(N(C)S(C)(=O)=O)c(-c3ccc4c(n3)-c3cc5c(F)cccc5n3CC4)cc12.

What is the InChIKey of N-[2-[6-(difluoromethyl)-3-pyridinyl]-5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-3-formyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methylmethanamine?

The InChIKey is UVPZDLMWTSGTNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H27F4N5O5S.C32H23F3N4O4S.C2H7N/c1-39-33(44)30-22-13-21(24-9-7-18-11-12-43-25-6-4-5-23(35)20(25)14-27(43)31(18)41-24)26(42(2)49(3,45)46)15-28(22)48-32(30)19-8-10-29(40-16-19)47-17-34(36,37)38;1-38(44(2,41)42)27-14-29-19(22(16-40)31(43-29)18-7-9-25(32(34)35)36-15-18)12-21(27)24-8-6-17-10-11-39-26-5-3-4-23(33)20(26)13-28(39)30(17)37-24;1-3-2/h4-10,13-16H,11-12,17H2,1-3H3,(H,39,44);3-9,12-16,32H,10-11H2,1-2H3;3H,1-2H3.

What are the key properties of N-[2-[6-(difluoromethyl)-3-pyridinyl]-5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-3-formyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methylmethanamine?

N-[2-[6-(difluoromethyl)-3-pyridinyl]-5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-3-formyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methylmethanamine has a molecular weight of 1355.38 g/mol, XLogP of 13.43, 13 rotatable bonds, 2 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[6-(difluoromethyl)-3-pyridinyl]-5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-3-formyl-1-benzofuran-6-yl]-N-methylmethanesulfonamide;5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-N-methyl-6-[methyl(methylsulfonyl)amino]-2-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-1-benzofuran-3-carboxamide;N-methylmethanamine is sourced from PubChem (CID 144681501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).