N-[2-[3-(4-carbamoyl-2-methoxyanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;2-iodo-1-(2,2,2-trifluoroethyl)indol-4-amine;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;3-methoxy-4-[3-[4-[[2-(1-methylpiperidin-4-yl)acetyl]amino]-1-(2,2,2-trifluoroethyl)indol-2-yl]prop-2-ynylamino]benzamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;3-methoxy-4-(prop-2-ynylamino)benzamide;1-methylpiperazine;1-methylpiperidin-4-amine

C189H222F21I3N36O21S3 — CID 167565331

About N-[2-[3-(4-carbamoyl-2-methoxyanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;2-iodo-1-(2,2,2-trifluoroethyl)indol-4-amine;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;3-methoxy-4-[3-[4-[[2-(1-methylpiperidin-4-yl)acetyl]amino]-1-(2,2,2-trifluoroethyl)indol-2-yl]prop-2-ynylamino]benzamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;3-methoxy-4-(prop-2-ynylamino)benzamide;1-methylpiperazine;1-methylpiperidin-4-amine

N-[2-[3-(4-carbamoyl-2-methoxyanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;2-iodo-1-(2,2,2-trifluoroethyl)indol-4-amine;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;3-methoxy-4-[3-[4-[[2-(1-methylpiperidin-4-yl)acetyl]amino]-1-(2,2,2-trifluoroethyl)indol-2-yl]prop-2-ynylamino]benzamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;3-methoxy-4-(prop-2-ynylamino)benzamide;1-methylpiperazine;1-methylpiperidin-4-amine (PubChem CID 167565331) has the molecular formula C189H222F21I3N36O21S3 and a molecular weight of 4209.96 g/mol. Its IUPAC name is N-[2-[3-(4-carbamoyl-2-methoxyanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;2-iodo-1-(2,2,2-trifluoroethyl)indol-4-amine;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;3-methoxy-4-[3-[4-[[2-(1-methylpiperidin-4-yl)acetyl]amino]-1-(2,2,2-trifluoroethyl)indol-2-yl]prop-2-ynylamino]benzamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;3-methoxy-4-(prop-2-ynylamino)benzamide;1-methylpiperazine;1-methylpiperidin-4-amine.

Molecular Properties

• Compound Name: N-[2-[3-(4-carbamoyl-2-methoxyanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;2-iodo-1-(2,2,2-trifluoroethyl)indol-4-amine;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;3-methoxy-4-[3-[4-[[2-(1-methylpiperidin-4-yl)acetyl]amino]-1-(2,2,2-trifluoroethyl)indol-2-yl]prop-2-ynylamino]benzamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;3-methoxy-4-(prop-2-ynylamino)benzamide;1-methylpiperazine;1-methylpiperidin-4-amine
• PubChem CID: 167565331
• Molecular Formula: C189H222F21I3N36O21S3
• Molecular Weight: 4209.96 g/mol
• Exact Mass: 4207.34
• IUPAC Name: N-[2-[3-(4-carbamoyl-2-methoxyanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;2-iodo-1-(2,2,2-trifluoroethyl)indol-4-amine;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;3-methoxy-4-[3-[4-[[2-(1-methylpiperidin-4-yl)acetyl]amino]-1-(2,2,2-trifluoroethyl)indol-2-yl]prop-2-ynylamino]benzamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;3-methoxy-4-(prop-2-ynylamino)benzamide;1-methylpiperazine;1-methylpiperidin-4-amine
• SMILES: C#CCNc1ccc(C(N)=O)cc1OC.C#CCNc1ccc(S(C)(=O)=O)cc1OC.CN1CCC(CC(=O)Nc2cccc3c2cc(I)n3CC(F)(F)F)CC1.CN1CCC(N)CC1.CN1CCN(C(=O)Nc2cccc3c2cc(I)n3CC(F)(F)F)CC1.CN1CCNCC1.COc1cc(C(N)=O)ccc1NCC#Cc1cc2c(NC(=O)CC3CCN(C)CC3)cccc2n1CC(F)(F)F.COc1cc(C(N)=O)ccc1NCC#Cc1cc2c(NC(=O)N3CCN(C)CC3)cccc2n1CC(F)(F)F.COc1cc(S(C)(=O)=O)ccc1NCC#Cc1cc2c(NC(=O)CC3CCN(C)CC3)cccc2n1CC(F)(F)F.COc1cc(S(C)(=O)=O)ccc1NCC#Cc1cc2c(NC(=O)N3CCN(C)CC3)cccc2n1CC(F)(F)F.Nc1cccc2c1cc(I)n2CC(F)(F)F
• InChI: InChI=1S/C29H32F3N5O3.C29H33F3N4O4S.C27H29F3N6O3.C27H30F3N5O4S.C18H21F3IN3O.C16H18F3IN4O.C11H12N2O2.C11H13NO3S.C10H8F3IN2.C6H14N2.C5H12N2/c1-36-13-10-19(11-14-36)15-27(38)35-23-6-3-7-25-22(23)17-21(37(25)18-29(30,31)32)5-4-12-34-24-9-8-20(28(33)39)16-26(24)40-2;1-35-14-11-20(12-15-35)16-28(37)34-24-7-4-8-26-23(24)17-21(36(26)19-29(30,31)32)6-5-13-33-25-10-9-22(41(3,38)39)18-27(25)40-2;1-34-11-13-35(14-12-34)26(38)33-21-6-3-7-23-20(21)16-19(36(23)17-27(28,29)30)5-4-10-32-22-9-8-18(25(31)37)15-24(22)39-2;1-33-12-14-34(15-13-33)26(36)32-22-7-4-8-24-21(22)16-19(35(24)18-27(28,29)30)6-5-11-31-23-10-9-20(40(3,37)38)17-25(23)39-2;1-24-7-5-12(6-8-24)9-17(26)23-14-3-2-4-15-13(14)10-16(22)25(15)11-18(19,20)21;1-22-5-7-23(8-6-22)15(25)21-12-3-2-4-13-11(12)9-14(20)24(13)10-16(17,18)19;1-3-6-13-9-5-4-8(11(12)14)7-10(9)15-2;1-4-7-12-10-6-5-9(16(3,13)14)8-11(10)15-2;11-10(12,13)5-16-8-3-1-2-7(15)6(8)4-9(16)14;1-8-4-2-6(7)3-5-8;1-7-4-2-6-3-5-7/h3,6-9,16-17,19,34H,10-15,18H2,1-2H3,(H2,33,39)(H,35,38);4,7-10,17-18,20,33H,11-16,19H2,1-3H3,(H,34,37);3,6-9,15-16,32H,10-14,17H2,1-2H3,(H2,31,37)(H,33,38);4,7-10,16-17,31H,11-15,18H2,1-3H3,(H,32,36);2-4,10,12H,5-9,11H2,1H3,(H,23,26);2-4,9H,5-8,10H2,1H3,(H,21,25);1,4-5,7,13H,6H2,2H3,(H2,12,14);1,5-6,8,12H,7H2,2-3H3;1-4H,5,15H2;6H,2-5,7H2,1H3;6H,2-5H2,1H3
• InChIKey: FEZBHSBMOVJUOT-UHFFFAOYSA-N
• XLogP: 29.61
• TPSA: 668.07 Ų
• H-Bond Donors: 18
• H-Bond Acceptors: 45
• Rotatable Bonds: 43
• Heavy Atoms: 273
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	4209.96
LogP ≤ 5	29.61
H-Bond Donors ≤ 5	18
H-Bond Acceptors ≤ 10	45

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-(4-carbamoyl-2-methoxyanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;2-iodo-1-(2,2,2-trifluoroethyl)indol-4-amine;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;3-methoxy-4-[3-[4-[[2-(1-methylpiperidin-4-yl)acetyl]amino]-1-(2,2,2-trifluoroethyl)indol-2-yl]prop-2-ynylamino]benzamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;3-methoxy-4-(prop-2-ynylamino)benzamide;1-methylpiperazine;1-methylpiperidin-4-amine?

The IUPAC name of N-[2-[3-(4-carbamoyl-2-methoxyanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;2-iodo-1-(2,2,2-trifluoroethyl)indol-4-amine;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;3-methoxy-4-[3-[4-[[2-(1-methylpiperidin-4-yl)acetyl]amino]-1-(2,2,2-trifluoroethyl)indol-2-yl]prop-2-ynylamino]benzamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;3-methoxy-4-(prop-2-ynylamino)benzamide;1-methylpiperazine;1-methylpiperidin-4-amine (CID 167565331) is N-[2-[3-(4-carbamoyl-2-methoxyanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;2-iodo-1-(2,2,2-trifluoroethyl)indol-4-amine;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;3-methoxy-4-[3-[4-[[2-(1-methylpiperidin-4-yl)acetyl]amino]-1-(2,2,2-trifluoroethyl)indol-2-yl]prop-2-ynylamino]benzamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;3-methoxy-4-(prop-2-ynylamino)benzamide;1-methylpiperazine;1-methylpiperidin-4-amine.

What is the SMILES notation for N-[2-[3-(4-carbamoyl-2-methoxyanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;2-iodo-1-(2,2,2-trifluoroethyl)indol-4-amine;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;3-methoxy-4-[3-[4-[[2-(1-methylpiperidin-4-yl)acetyl]amino]-1-(2,2,2-trifluoroethyl)indol-2-yl]prop-2-ynylamino]benzamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;3-methoxy-4-(prop-2-ynylamino)benzamide;1-methylpiperazine;1-methylpiperidin-4-amine?

The canonical SMILES for N-[2-[3-(4-carbamoyl-2-methoxyanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;2-iodo-1-(2,2,2-trifluoroethyl)indol-4-amine;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;3-methoxy-4-[3-[4-[[2-(1-methylpiperidin-4-yl)acetyl]amino]-1-(2,2,2-trifluoroethyl)indol-2-yl]prop-2-ynylamino]benzamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;3-methoxy-4-(prop-2-ynylamino)benzamide;1-methylpiperazine;1-methylpiperidin-4-amine is C#CCNc1ccc(C(N)=O)cc1OC.C#CCNc1ccc(S(C)(=O)=O)cc1OC.CN1CCC(CC(=O)Nc2cccc3c2cc(I)n3CC(F)(F)F)CC1.CN1CCC(N)CC1.CN1CCN(C(=O)Nc2cccc3c2cc(I)n3CC(F)(F)F)CC1.CN1CCNCC1.COc1cc(C(N)=O)ccc1NCC#Cc1cc2c(NC(=O)CC3CCN(C)CC3)cccc2n1CC(F)(F)F.COc1cc(C(N)=O)ccc1NCC#Cc1cc2c(NC(=O)N3CCN(C)CC3)cccc2n1CC(F)(F)F.COc1cc(S(C)(=O)=O)ccc1NCC#Cc1cc2c(NC(=O)CC3CCN(C)CC3)cccc2n1CC(F)(F)F.COc1cc(S(C)(=O)=O)ccc1NCC#Cc1cc2c(NC(=O)N3CCN(C)CC3)cccc2n1CC(F)(F)F.Nc1cccc2c1cc(I)n2CC(F)(F)F.

What is the InChIKey of N-[2-[3-(4-carbamoyl-2-methoxyanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;2-iodo-1-(2,2,2-trifluoroethyl)indol-4-amine;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;3-methoxy-4-[3-[4-[[2-(1-methylpiperidin-4-yl)acetyl]amino]-1-(2,2,2-trifluoroethyl)indol-2-yl]prop-2-ynylamino]benzamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;3-methoxy-4-(prop-2-ynylamino)benzamide;1-methylpiperazine;1-methylpiperidin-4-amine?

The InChIKey is FEZBHSBMOVJUOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H32F3N5O3.C29H33F3N4O4S.C27H29F3N6O3.C27H30F3N5O4S.C18H21F3IN3O.C16H18F3IN4O.C11H12N2O2.C11H13NO3S.C10H8F3IN2.C6H14N2.C5H12N2/c1-36-13-10-19(11-14-36)15-27(38)35-23-6-3-7-25-22(23)17-21(37(25)18-29(30,31)32)5-4-12-34-24-9-8-20(28(33)39)16-26(24)40-2;1-35-14-11-20(12-15-35)16-28(37)34-24-7-4-8-26-23(24)17-21(36(26)19-29(30,31)32)6-5-13-33-25-10-9-22(41(3,38)39)18-27(25)40-2;1-34-11-13-35(14-12-34)26(38)33-21-6-3-7-23-20(21)16-19(36(23)17-27(28,29)30)5-4-10-32-22-9-8-18(25(31)37)15-24(22)39-2;1-33-12-14-34(15-13-33)26(36)32-22-7-4-8-24-21(22)16-19(35(24)18-27(28,29)30)6-5-11-31-23-10-9-20(40(3,37)38)17-25(23)39-2;1-24-7-5-12(6-8-24)9-17(26)23-14-3-2-4-15-13(14)10-16(22)25(15)11-18(19,20)21;1-22-5-7-23(8-6-22)15(25)21-12-3-2-4-13-11(12)9-14(20)24(13)10-16(17,18)19;1-3-6-13-9-5-4-8(11(12)14)7-10(9)15-2;1-4-7-12-10-6-5-9(16(3,13)14)8-11(10)15-2;11-10(12,13)5-16-8-3-1-2-7(15)6(8)4-9(16)14;1-8-4-2-6(7)3-5-8;1-7-4-2-6-3-5-7/h3,6-9,16-17,19,34H,10-15,18H2,1-2H3,(H2,33,39)(H,35,38);4,7-10,17-18,20,33H,11-16,19H2,1-3H3,(H,34,37);3,6-9,15-16,32H,10-14,17H2,1-2H3,(H2,31,37)(H,33,38);4,7-10,16-17,31H,11-15,18H2,1-3H3,(H,32,36);2-4,10,12H,5-9,11H2,1H3,(H,23,26);2-4,9H,5-8,10H2,1H3,(H,21,25);1,4-5,7,13H,6H2,2H3,(H2,12,14);1,5-6,8,12H,7H2,2-3H3;1-4H,5,15H2;6H,2-5,7H2,1H3;6H,2-5H2,1H3.

What are the key properties of N-[2-[3-(4-carbamoyl-2-methoxyanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;2-iodo-1-(2,2,2-trifluoroethyl)indol-4-amine;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;3-methoxy-4-[3-[4-[[2-(1-methylpiperidin-4-yl)acetyl]amino]-1-(2,2,2-trifluoroethyl)indol-2-yl]prop-2-ynylamino]benzamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;3-methoxy-4-(prop-2-ynylamino)benzamide;1-methylpiperazine;1-methylpiperidin-4-amine?

N-[2-[3-(4-carbamoyl-2-methoxyanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;2-iodo-1-(2,2,2-trifluoroethyl)indol-4-amine;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;3-methoxy-4-[3-[4-[[2-(1-methylpiperidin-4-yl)acetyl]amino]-1-(2,2,2-trifluoroethyl)indol-2-yl]prop-2-ynylamino]benzamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;3-methoxy-4-(prop-2-ynylamino)benzamide;1-methylpiperazine;1-methylpiperidin-4-amine has a molecular weight of 4209.96 g/mol, XLogP of 29.61, 43 rotatable bonds, 18 hydrogen bond donors, and 45 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[3-(4-carbamoyl-2-methoxyanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;2-iodo-1-(2,2,2-trifluoroethyl)indol-4-amine;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-iodo-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;3-methoxy-4-[3-[4-[[2-(1-methylpiperidin-4-yl)acetyl]amino]-1-(2,2,2-trifluoroethyl)indol-2-yl]prop-2-ynylamino]benzamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-4-methylpiperazine-1-carboxamide;N-[2-[3-(2-methoxy-4-methylsulfonylanilino)prop-1-ynyl]-1-(2,2,2-trifluoroethyl)indol-4-yl]-2-(1-methylpiperidin-4-yl)acetamide;2-methoxy-4-methylsulfonyl-N-prop-2-ynylaniline;3-methoxy-4-(prop-2-ynylamino)benzamide;1-methylpiperazine;1-methylpiperidin-4-amine is sourced from PubChem (CID 167565331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).