dipotassium;2,2-difluoropropan-1-ol;1-(2,2-difluoropropyl)-2-iodoindol-4-amine;1-[4-[[1-(2,2-difluoropropyl)-2-iodoindol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;1-(2,2-difluoropropyl)-2-iodo-4-nitroindole;1-[4-[[1-(2,2-difluoropropyl)-2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]indol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;2,2-difluoropropyl trifluoromethanesulfonate;hydride;1-(2-hydroxy-3-methoxypropyl)piperidin-4-one;2-iodo-4-nitro-1H-indene;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;oxido formate;palladium;tetrakis(triphenylphosphane)

C182H197F15I4K2N14O24P4PdS3 — CID 167568243

About dipotassium;2,2-difluoropropan-1-ol;1-(2,2-difluoropropyl)-2-iodoindol-4-amine;1-[4-[[1-(2,2-difluoropropyl)-2-iodoindol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;1-(2,2-difluoropropyl)-2-iodo-4-nitroindole;1-[4-[[1-(2,2-difluoropropyl)-2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]indol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;2,2-difluoropropyl trifluoromethanesulfonate;hydride;1-(2-hydroxy-3-methoxypropyl)piperidin-4-one;2-iodo-4-nitro-1H-indene;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;oxido formate;palladium;tetrakis(triphenylphosphane)

dipotassium;2,2-difluoropropan-1-ol;1-(2,2-difluoropropyl)-2-iodoindol-4-amine;1-[4-[[1-(2,2-difluoropropyl)-2-iodoindol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;1-(2,2-difluoropropyl)-2-iodo-4-nitroindole;1-[4-[[1-(2,2-difluoropropyl)-2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]indol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;2,2-difluoropropyl trifluoromethanesulfonate;hydride;1-(2-hydroxy-3-methoxypropyl)piperidin-4-one;2-iodo-4-nitro-1H-indene;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;oxido formate;palladium;tetrakis(triphenylphosphane) (PubChem CID 167568243) has the molecular formula C182H197F15I4K2N14O24P4PdS3 and a molecular weight of 4161.95 g/mol. Its IUPAC name is dipotassium;2,2-difluoropropan-1-ol;1-(2,2-difluoropropyl)-2-iodoindol-4-amine;1-[4-[[1-(2,2-difluoropropyl)-2-iodoindol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;1-(2,2-difluoropropyl)-2-iodo-4-nitroindole;1-[4-[[1-(2,2-difluoropropyl)-2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]indol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;2,2-difluoropropyl trifluoromethanesulfonate;hydride;1-(2-hydroxy-3-methoxypropyl)piperidin-4-one;2-iodo-4-nitro-1H-indene;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;oxido formate;palladium;tetrakis(triphenylphosphane).

Molecular Properties

• Compound Name: dipotassium;2,2-difluoropropan-1-ol;1-(2,2-difluoropropyl)-2-iodoindol-4-amine;1-[4-[[1-(2,2-difluoropropyl)-2-iodoindol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;1-(2,2-difluoropropyl)-2-iodo-4-nitroindole;1-[4-[[1-(2,2-difluoropropyl)-2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]indol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;2,2-difluoropropyl trifluoromethanesulfonate;hydride;1-(2-hydroxy-3-methoxypropyl)piperidin-4-one;2-iodo-4-nitro-1H-indene;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;oxido formate;palladium;tetrakis(triphenylphosphane)
• PubChem CID: 167568243
• Molecular Formula: C182H197F15I4K2N14O24P4PdS3
• Molecular Weight: 4161.95 g/mol
• Exact Mass: 4158.70
• IUPAC Name: dipotassium;2,2-difluoropropan-1-ol;1-(2,2-difluoropropyl)-2-iodoindol-4-amine;1-[4-[[1-(2,2-difluoropropyl)-2-iodoindol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;1-(2,2-difluoropropyl)-2-iodo-4-nitroindole;1-[4-[[1-(2,2-difluoropropyl)-2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]indol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;2,2-difluoropropyl trifluoromethanesulfonate;hydride;1-(2-hydroxy-3-methoxypropyl)piperidin-4-one;2-iodo-4-nitro-1H-indene;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;oxido formate;palladium;tetrakis(triphenylphosphane)
• SMILES: C#CCNc1ccc(S(C)(=O)=O)cc1OC.CC(F)(F)CO.CC(F)(F)COS(=O)(=O)C(F)(F)F.CC(F)(F)Cn1c(I)cc2c(N)cccc21.CC(F)(F)Cn1c(I)cc2c([N+](=O)[O-])cccc21.COCC(O)CN1CCC(=O)CC1.COCC(O)CN1CCC(Nc2cccc3c2cc(C#CCNc2ccc(S(C)(=O)=O)cc2OC)n3CC(C)(F)F)CC1.COCC(O)CN1CCC(Nc2cccc3c2cc(I)n3CC(C)(F)F)CC1.O=CO[O-].O=[N+]([O-])c1cccc2c1C=C(I)C2.[H-].[K+].[K+].[Pd].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
• InChI: InChI=1S/C31H40F2N4O5S.C20H28F2IN3O2.4C18H15P.C11H9F2IN2O2.C11H11F2IN2.C11H13NO3S.C9H6INO2.C9H17NO3.C4H5F5O3S.C3H6F2O.CH2O3.2K.Pd.H/c1-31(32,33)21-37-23(7-6-14-34-28-11-10-25(43(4,39)40)18-30(28)42-3)17-26-27(8-5-9-29(26)37)35-22-12-15-36(16-13-22)19-24(38)20-41-2;1-20(21,22)13-26-18-5-3-4-17(16(18)10-19(26)23)24-14-6-8-25(9-7-14)11-15(27)12-28-2;4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-11(12,13)6-15-8-3-2-4-9(16(17)18)7(8)5-10(15)14;1-11(12,13)6-16-9-4-2-3-8(15)7(9)5-10(16)14;1-4-7-12-10-6-5-9(16(3,13)14)8-11(10)15-2;10-7-4-6-2-1-3-9(11(12)13)8(6)5-7;1-13-7-9(12)6-10-4-2-8(11)3-5-10;1-3(5,6)2-12-13(10,11)4(7,8)9;1-3(4,5)2-6;2-1-4-3;;;;/h5,8-11,17-18,22,24,34-35,38H,12-16,19-21H2,1-4H3;3-5,10,14-15,24,27H,6-9,11-13H2,1-2H3;4*1-15H;2-5H,6H2,1H3;2-5H,6,15H2,1H3;1,5-6,8,12H,7H2,2-3H3;1-3,5H,4H2;9,12H,2-7H2,1H3;2H2,1H3;6H,2H2,1H3;1,3H;;;;/q;;;;;;;;;;;;;;2*+1;;-1/p-1
• InChIKey: YGMUVJNPHRGELH-UHFFFAOYSA-M
• XLogP: 27.34
• TPSA: 495.01 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 36
• Rotatable Bonds: 51
• Heavy Atoms: 249
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	4161.95
LogP ≤ 5	27.34
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of dipotassium;2,2-difluoropropan-1-ol;1-(2,2-difluoropropyl)-2-iodoindol-4-amine;1-[4-[[1-(2,2-difluoropropyl)-2-iodoindol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;1-(2,2-difluoropropyl)-2-iodo-4-nitroindole;1-[4-[[1-(2,2-difluoropropyl)-2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]indol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;2,2-difluoropropyl trifluoromethanesulfonate;hydride;1-(2-hydroxy-3-methoxypropyl)piperidin-4-one;2-iodo-4-nitro-1H-indene;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;oxido formate;palladium;tetrakis(triphenylphosphane)?

The IUPAC name of dipotassium;2,2-difluoropropan-1-ol;1-(2,2-difluoropropyl)-2-iodoindol-4-amine;1-[4-[[1-(2,2-difluoropropyl)-2-iodoindol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;1-(2,2-difluoropropyl)-2-iodo-4-nitroindole;1-[4-[[1-(2,2-difluoropropyl)-2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]indol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;2,2-difluoropropyl trifluoromethanesulfonate;hydride;1-(2-hydroxy-3-methoxypropyl)piperidin-4-one;2-iodo-4-nitro-1H-indene;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;oxido formate;palladium;tetrakis(triphenylphosphane) (CID 167568243) is dipotassium;2,2-difluoropropan-1-ol;1-(2,2-difluoropropyl)-2-iodoindol-4-amine;1-[4-[[1-(2,2-difluoropropyl)-2-iodoindol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;1-(2,2-difluoropropyl)-2-iodo-4-nitroindole;1-[4-[[1-(2,2-difluoropropyl)-2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]indol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;2,2-difluoropropyl trifluoromethanesulfonate;hydride;1-(2-hydroxy-3-methoxypropyl)piperidin-4-one;2-iodo-4-nitro-1H-indene;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;oxido formate;palladium;tetrakis(triphenylphosphane).

What is the SMILES notation for dipotassium;2,2-difluoropropan-1-ol;1-(2,2-difluoropropyl)-2-iodoindol-4-amine;1-[4-[[1-(2,2-difluoropropyl)-2-iodoindol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;1-(2,2-difluoropropyl)-2-iodo-4-nitroindole;1-[4-[[1-(2,2-difluoropropyl)-2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]indol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;2,2-difluoropropyl trifluoromethanesulfonate;hydride;1-(2-hydroxy-3-methoxypropyl)piperidin-4-one;2-iodo-4-nitro-1H-indene;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;oxido formate;palladium;tetrakis(triphenylphosphane)?

The canonical SMILES for dipotassium;2,2-difluoropropan-1-ol;1-(2,2-difluoropropyl)-2-iodoindol-4-amine;1-[4-[[1-(2,2-difluoropropyl)-2-iodoindol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;1-(2,2-difluoropropyl)-2-iodo-4-nitroindole;1-[4-[[1-(2,2-difluoropropyl)-2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]indol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;2,2-difluoropropyl trifluoromethanesulfonate;hydride;1-(2-hydroxy-3-methoxypropyl)piperidin-4-one;2-iodo-4-nitro-1H-indene;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;oxido formate;palladium;tetrakis(triphenylphosphane) is C#CCNc1ccc(S(C)(=O)=O)cc1OC.CC(F)(F)CO.CC(F)(F)COS(=O)(=O)C(F)(F)F.CC(F)(F)Cn1c(I)cc2c(N)cccc21.CC(F)(F)Cn1c(I)cc2c([N+](=O)[O-])cccc21.COCC(O)CN1CCC(=O)CC1.COCC(O)CN1CCC(Nc2cccc3c2cc(C#CCNc2ccc(S(C)(=O)=O)cc2OC)n3CC(C)(F)F)CC1.COCC(O)CN1CCC(Nc2cccc3c2cc(I)n3CC(C)(F)F)CC1.O=CO[O-].O=[N+]([O-])c1cccc2c1C=C(I)C2.[H-].[K+].[K+].[Pd].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.

What is the InChIKey of dipotassium;2,2-difluoropropan-1-ol;1-(2,2-difluoropropyl)-2-iodoindol-4-amine;1-[4-[[1-(2,2-difluoropropyl)-2-iodoindol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;1-(2,2-difluoropropyl)-2-iodo-4-nitroindole;1-[4-[[1-(2,2-difluoropropyl)-2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]indol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;2,2-difluoropropyl trifluoromethanesulfonate;hydride;1-(2-hydroxy-3-methoxypropyl)piperidin-4-one;2-iodo-4-nitro-1H-indene;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;oxido formate;palladium;tetrakis(triphenylphosphane)?

The InChIKey is YGMUVJNPHRGELH-UHFFFAOYSA-M. The full InChI is InChI=1S/C31H40F2N4O5S.C20H28F2IN3O2.4C18H15P.C11H9F2IN2O2.C11H11F2IN2.C11H13NO3S.C9H6INO2.C9H17NO3.C4H5F5O3S.C3H6F2O.CH2O3.2K.Pd.H/c1-31(32,33)21-37-23(7-6-14-34-28-11-10-25(43(4,39)40)18-30(28)42-3)17-26-27(8-5-9-29(26)37)35-22-12-15-36(16-13-22)19-24(38)20-41-2;1-20(21,22)13-26-18-5-3-4-17(16(18)10-19(26)23)24-14-6-8-25(9-7-14)11-15(27)12-28-2;4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-11(12,13)6-15-8-3-2-4-9(16(17)18)7(8)5-10(15)14;1-11(12,13)6-16-9-4-2-3-8(15)7(9)5-10(16)14;1-4-7-12-10-6-5-9(16(3,13)14)8-11(10)15-2;10-7-4-6-2-1-3-9(11(12)13)8(6)5-7;1-13-7-9(12)6-10-4-2-8(11)3-5-10;1-3(5,6)2-12-13(10,11)4(7,8)9;1-3(4,5)2-6;2-1-4-3;;;;/h5,8-11,17-18,22,24,34-35,38H,12-16,19-21H2,1-4H3;3-5,10,14-15,24,27H,6-9,11-13H2,1-2H3;4*1-15H;2-5H,6H2,1H3;2-5H,6,15H2,1H3;1,5-6,8,12H,7H2,2-3H3;1-3,5H,4H2;9,12H,2-7H2,1H3;2H2,1H3;6H,2H2,1H3;1,3H;;;;/q;;;;;;;;;;;;;;2*+1;;-1/p-1.

What are the key properties of dipotassium;2,2-difluoropropan-1-ol;1-(2,2-difluoropropyl)-2-iodoindol-4-amine;1-[4-[[1-(2,2-difluoropropyl)-2-iodoindol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;1-(2,2-difluoropropyl)-2-iodo-4-nitroindole;1-[4-[[1-(2,2-difluoropropyl)-2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]indol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;2,2-difluoropropyl trifluoromethanesulfonate;hydride;1-(2-hydroxy-3-methoxypropyl)piperidin-4-one;2-iodo-4-nitro-1H-indene;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;oxido formate;palladium;tetrakis(triphenylphosphane)?

dipotassium;2,2-difluoropropan-1-ol;1-(2,2-difluoropropyl)-2-iodoindol-4-amine;1-[4-[[1-(2,2-difluoropropyl)-2-iodoindol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;1-(2,2-difluoropropyl)-2-iodo-4-nitroindole;1-[4-[[1-(2,2-difluoropropyl)-2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]indol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;2,2-difluoropropyl trifluoromethanesulfonate;hydride;1-(2-hydroxy-3-methoxypropyl)piperidin-4-one;2-iodo-4-nitro-1H-indene;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;oxido formate;palladium;tetrakis(triphenylphosphane) has a molecular weight of 4161.95 g/mol, XLogP of 27.34, 51 rotatable bonds, 9 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for dipotassium;2,2-difluoropropan-1-ol;1-(2,2-difluoropropyl)-2-iodoindol-4-amine;1-[4-[[1-(2,2-difluoropropyl)-2-iodoindol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;1-(2,2-difluoropropyl)-2-iodo-4-nitroindole;1-[4-[[1-(2,2-difluoropropyl)-2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]indol-4-yl]amino]piperidin-1-yl]-3-methoxypropan-2-ol;2,2-difluoropropyl trifluoromethanesulfonate;hydride;1-(2-hydroxy-3-methoxypropyl)piperidin-4-one;2-iodo-4-nitro-1H-indene;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;oxido formate;palladium;tetrakis(triphenylphosphane) is sourced from PubChem (CID 167568243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).