4-(5-aminopentylamino)-N-cyclohexylbenzamide;N'-(2-cyclohexylcyclohexyl)pentane-1,5-diamine;N-[5-(4-cyclopentyloxyanilino)pentyl]propane-2-sulfonamide;N-[5-[(1,3-dimethyl-2,3-dihydro-1H-inden-5-yl)amino]pentyl]propane-2-sulfonamide;N-[5-[4-(3,4-dimethylphenyl)anilino]pentyl]propane-2-sulfonamide;N'-[2,3-dimethyl-4-[(2R,3S,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]pentane-1,5-diamine;N'-(3-fluoro-4-methylphenyl)pentane-1,5-diamine;N-[5-[4-fluoro-3-(trifluoromethyl)anilino]pentyl]propane-2-sulfonamide;tetrakis(propane-2-sulfinate)

C154H263F5N18O19S8-4 — CID 157146306

About 4-(5-aminopentylamino)-N-cyclohexylbenzamide;N'-(2-cyclohexylcyclohexyl)pentane-1,5-diamine;N-[5-(4-cyclopentyloxyanilino)pentyl]propane-2-sulfonamide;N-[5-[(1,3-dimethyl-2,3-dihydro-1H-inden-5-yl)amino]pentyl]propane-2-sulfonamide;N-[5-[4-(3,4-dimethylphenyl)anilino]pentyl]propane-2-sulfonamide;N'-[2,3-dimethyl-4-[(2R,3S,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]pentane-1,5-diamine;N'-(3-fluoro-4-methylphenyl)pentane-1,5-diamine;N-[5-[4-fluoro-3-(trifluoromethyl)anilino]pentyl]propane-2-sulfonamide;tetrakis(propane-2-sulfinate)

4-(5-aminopentylamino)-N-cyclohexylbenzamide;N'-(2-cyclohexylcyclohexyl)pentane-1,5-diamine;N-[5-(4-cyclopentyloxyanilino)pentyl]propane-2-sulfonamide;N-[5-[(1,3-dimethyl-2,3-dihydro-1H-inden-5-yl)amino]pentyl]propane-2-sulfonamide;N-[5-[4-(3,4-dimethylphenyl)anilino]pentyl]propane-2-sulfonamide;N'-[2,3-dimethyl-4-[(2R,3S,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]pentane-1,5-diamine;N'-(3-fluoro-4-methylphenyl)pentane-1,5-diamine;N-[5-[4-fluoro-3-(trifluoromethyl)anilino]pentyl]propane-2-sulfonamide;tetrakis(propane-2-sulfinate) (PubChem CID 157146306) has the molecular formula C154H263F5N18O19S8-4 and a molecular weight of 3022.43 g/mol. Its IUPAC name is 4-(5-aminopentylamino)-N-cyclohexylbenzamide;N'-(2-cyclohexylcyclohexyl)pentane-1,5-diamine;N-[5-(4-cyclopentyloxyanilino)pentyl]propane-2-sulfonamide;N-[5-[(1,3-dimethyl-2,3-dihydro-1H-inden-5-yl)amino]pentyl]propane-2-sulfonamide;N-[5-[4-(3,4-dimethylphenyl)anilino]pentyl]propane-2-sulfonamide;N'-[2,3-dimethyl-4-[(2R,3S,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]pentane-1,5-diamine;N'-(3-fluoro-4-methylphenyl)pentane-1,5-diamine;N-[5-[4-fluoro-3-(trifluoromethyl)anilino]pentyl]propane-2-sulfonamide;tetrakis(propane-2-sulfinate).

Molecular Properties

• Compound Name: 4-(5-aminopentylamino)-N-cyclohexylbenzamide;N'-(2-cyclohexylcyclohexyl)pentane-1,5-diamine;N-[5-(4-cyclopentyloxyanilino)pentyl]propane-2-sulfonamide;N-[5-[(1,3-dimethyl-2,3-dihydro-1H-inden-5-yl)amino]pentyl]propane-2-sulfonamide;N-[5-[4-(3,4-dimethylphenyl)anilino]pentyl]propane-2-sulfonamide;N'-[2,3-dimethyl-4-[(2R,3S,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]pentane-1,5-diamine;N'-(3-fluoro-4-methylphenyl)pentane-1,5-diamine;N-[5-[4-fluoro-3-(trifluoromethyl)anilino]pentyl]propane-2-sulfonamide;tetrakis(propane-2-sulfinate)
• PubChem CID: 157146306
• Molecular Formula: C154H263F5N18O19S8-4
• Molecular Weight: 3022.43 g/mol
• Exact Mass: 3019.79
• IUPAC Name: 4-(5-aminopentylamino)-N-cyclohexylbenzamide;N'-(2-cyclohexylcyclohexyl)pentane-1,5-diamine;N-[5-(4-cyclopentyloxyanilino)pentyl]propane-2-sulfonamide;N-[5-[(1,3-dimethyl-2,3-dihydro-1H-inden-5-yl)amino]pentyl]propane-2-sulfonamide;N-[5-[4-(3,4-dimethylphenyl)anilino]pentyl]propane-2-sulfonamide;N'-[2,3-dimethyl-4-[(2R,3S,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]pentane-1,5-diamine;N'-(3-fluoro-4-methylphenyl)pentane-1,5-diamine;N-[5-[4-fluoro-3-(trifluoromethyl)anilino]pentyl]propane-2-sulfonamide;tetrakis(propane-2-sulfinate)
• SMILES: CC(C)S(=O)(=O)NCCCCCNc1ccc(F)c(C(F)(F)F)c1.CC(C)S(=O)(=O)NCCCCCNc1ccc(OC2CCCC2)cc1.CC(C)S(=O)[O-].CC(C)S(=O)[O-].CC(C)S(=O)[O-].CC(C)S(=O)[O-].CC1CC(C)c2cc(NCCCCCNS(=O)(=O)C(C)C)ccc21.Cc1c(NCCCCCN)ccc(N2C[C@H](C)O[C@H](C)[C@@H]2C)c1C.Cc1ccc(-c2ccc(NCCCCCNS(=O)(=O)C(C)C)cc2)cc1C.Cc1ccc(NCCCCCN)cc1F.NCCCCCNC1CCCCC1C1CCCCC1.NCCCCCNc1ccc(C(=O)NC2CCCCC2)cc1
• InChI: InChI=1S/C22H32N2O2S.C20H35N3O.C19H32N2O3S.C19H32N2O2S.C18H29N3O.C17H34N2.C15H22F4N2O2S.C12H19FN2.4C3H8O2S/c1-17(2)27(25,26)24-15-7-5-6-14-23-22-12-10-20(11-13-22)21-9-8-18(3)19(4)16-21;1-14-13-23(17(4)18(5)24-14)20-10-9-19(15(2)16(20)3)22-12-8-6-7-11-21;1-16(2)25(22,23)21-15-7-3-6-14-20-17-10-12-19(13-11-17)24-18-8-4-5-9-18;1-14(2)24(22,23)21-11-7-5-6-10-20-17-8-9-18-15(3)12-16(4)19(18)13-17;19-13-5-2-6-14-20-16-11-9-15(10-12-16)18(22)21-17-7-3-1-4-8-17;18-13-7-2-8-14-19-17-12-6-5-11-16(17)15-9-3-1-4-10-15;1-11(2)24(22,23)21-9-5-3-4-8-20-12-6-7-14(16)13(10-12)15(17,18)19;1-10-5-6-11(9-12(10)13)15-8-4-2-3-7-14;4*1-3(2)6(4)5/h8-13,16-17,23-24H,5-7,14-15H2,1-4H3;9-10,14,17-18,22H,6-8,11-13,21H2,1-5H3;10-13,16,18,20-21H,3-9,14-15H2,1-2H3;8-9,13-16,20-21H,5-7,10-12H2,1-4H3;9-12,17,20H,1-8,13-14,19H2,(H,21,22);15-17,19H,1-14,18H2;6-7,10-11,20-21H,3-5,8-9H2,1-2H3;5-6,9,15H,2-4,7-8,14H2,1H3;4*3H,1-2H3,(H,4,5)/p-4/t;14-,17-,18+;;;;;;;;;;/m.0........../s1
• InChIKey: UCEUBKUSRSEKAT-USPMAVACSA-J
• XLogP: 31.51
• TPSA: 596.32 Ų
• H-Bond Donors: 17
• H-Bond Acceptors: 32
• Rotatable Bonds: 71
• Heavy Atoms: 204
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3022.43
LogP ≤ 5	31.51
H-Bond Donors ≤ 5	17
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'sulfinic_acid', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-(5-aminopentylamino)-N-cyclohexylbenzamide;N'-(2-cyclohexylcyclohexyl)pentane-1,5-diamine;N-[5-(4-cyclopentyloxyanilino)pentyl]propane-2-sulfonamide;N-[5-[(1,3-dimethyl-2,3-dihydro-1H-inden-5-yl)amino]pentyl]propane-2-sulfonamide;N-[5-[4-(3,4-dimethylphenyl)anilino]pentyl]propane-2-sulfonamide;N'-[2,3-dimethyl-4-[(2R,3S,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]pentane-1,5-diamine;N'-(3-fluoro-4-methylphenyl)pentane-1,5-diamine;N-[5-[4-fluoro-3-(trifluoromethyl)anilino]pentyl]propane-2-sulfonamide;tetrakis(propane-2-sulfinate)?

The IUPAC name of 4-(5-aminopentylamino)-N-cyclohexylbenzamide;N'-(2-cyclohexylcyclohexyl)pentane-1,5-diamine;N-[5-(4-cyclopentyloxyanilino)pentyl]propane-2-sulfonamide;N-[5-[(1,3-dimethyl-2,3-dihydro-1H-inden-5-yl)amino]pentyl]propane-2-sulfonamide;N-[5-[4-(3,4-dimethylphenyl)anilino]pentyl]propane-2-sulfonamide;N'-[2,3-dimethyl-4-[(2R,3S,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]pentane-1,5-diamine;N'-(3-fluoro-4-methylphenyl)pentane-1,5-diamine;N-[5-[4-fluoro-3-(trifluoromethyl)anilino]pentyl]propane-2-sulfonamide;tetrakis(propane-2-sulfinate) (CID 157146306) is 4-(5-aminopentylamino)-N-cyclohexylbenzamide;N'-(2-cyclohexylcyclohexyl)pentane-1,5-diamine;N-[5-(4-cyclopentyloxyanilino)pentyl]propane-2-sulfonamide;N-[5-[(1,3-dimethyl-2,3-dihydro-1H-inden-5-yl)amino]pentyl]propane-2-sulfonamide;N-[5-[4-(3,4-dimethylphenyl)anilino]pentyl]propane-2-sulfonamide;N'-[2,3-dimethyl-4-[(2R,3S,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]pentane-1,5-diamine;N'-(3-fluoro-4-methylphenyl)pentane-1,5-diamine;N-[5-[4-fluoro-3-(trifluoromethyl)anilino]pentyl]propane-2-sulfonamide;tetrakis(propane-2-sulfinate).

What is the SMILES notation for 4-(5-aminopentylamino)-N-cyclohexylbenzamide;N'-(2-cyclohexylcyclohexyl)pentane-1,5-diamine;N-[5-(4-cyclopentyloxyanilino)pentyl]propane-2-sulfonamide;N-[5-[(1,3-dimethyl-2,3-dihydro-1H-inden-5-yl)amino]pentyl]propane-2-sulfonamide;N-[5-[4-(3,4-dimethylphenyl)anilino]pentyl]propane-2-sulfonamide;N'-[2,3-dimethyl-4-[(2R,3S,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]pentane-1,5-diamine;N'-(3-fluoro-4-methylphenyl)pentane-1,5-diamine;N-[5-[4-fluoro-3-(trifluoromethyl)anilino]pentyl]propane-2-sulfonamide;tetrakis(propane-2-sulfinate)?

The canonical SMILES for 4-(5-aminopentylamino)-N-cyclohexylbenzamide;N'-(2-cyclohexylcyclohexyl)pentane-1,5-diamine;N-[5-(4-cyclopentyloxyanilino)pentyl]propane-2-sulfonamide;N-[5-[(1,3-dimethyl-2,3-dihydro-1H-inden-5-yl)amino]pentyl]propane-2-sulfonamide;N-[5-[4-(3,4-dimethylphenyl)anilino]pentyl]propane-2-sulfonamide;N'-[2,3-dimethyl-4-[(2R,3S,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]pentane-1,5-diamine;N'-(3-fluoro-4-methylphenyl)pentane-1,5-diamine;N-[5-[4-fluoro-3-(trifluoromethyl)anilino]pentyl]propane-2-sulfonamide;tetrakis(propane-2-sulfinate) is CC(C)S(=O)(=O)NCCCCCNc1ccc(F)c(C(F)(F)F)c1.CC(C)S(=O)(=O)NCCCCCNc1ccc(OC2CCCC2)cc1.CC(C)S(=O)[O-].CC(C)S(=O)[O-].CC(C)S(=O)[O-].CC(C)S(=O)[O-].CC1CC(C)c2cc(NCCCCCNS(=O)(=O)C(C)C)ccc21.Cc1c(NCCCCCN)ccc(N2C[C@H](C)O[C@H](C)[C@@H]2C)c1C.Cc1ccc(-c2ccc(NCCCCCNS(=O)(=O)C(C)C)cc2)cc1C.Cc1ccc(NCCCCCN)cc1F.NCCCCCNC1CCCCC1C1CCCCC1.NCCCCCNc1ccc(C(=O)NC2CCCCC2)cc1.

What is the InChIKey of 4-(5-aminopentylamino)-N-cyclohexylbenzamide;N'-(2-cyclohexylcyclohexyl)pentane-1,5-diamine;N-[5-(4-cyclopentyloxyanilino)pentyl]propane-2-sulfonamide;N-[5-[(1,3-dimethyl-2,3-dihydro-1H-inden-5-yl)amino]pentyl]propane-2-sulfonamide;N-[5-[4-(3,4-dimethylphenyl)anilino]pentyl]propane-2-sulfonamide;N'-[2,3-dimethyl-4-[(2R,3S,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]pentane-1,5-diamine;N'-(3-fluoro-4-methylphenyl)pentane-1,5-diamine;N-[5-[4-fluoro-3-(trifluoromethyl)anilino]pentyl]propane-2-sulfonamide;tetrakis(propane-2-sulfinate)?

The InChIKey is UCEUBKUSRSEKAT-USPMAVACSA-J. The full InChI is InChI=1S/C22H32N2O2S.C20H35N3O.C19H32N2O3S.C19H32N2O2S.C18H29N3O.C17H34N2.C15H22F4N2O2S.C12H19FN2.4C3H8O2S/c1-17(2)27(25,26)24-15-7-5-6-14-23-22-12-10-20(11-13-22)21-9-8-18(3)19(4)16-21;1-14-13-23(17(4)18(5)24-14)20-10-9-19(15(2)16(20)3)22-12-8-6-7-11-21;1-16(2)25(22,23)21-15-7-3-6-14-20-17-10-12-19(13-11-17)24-18-8-4-5-9-18;1-14(2)24(22,23)21-11-7-5-6-10-20-17-8-9-18-15(3)12-16(4)19(18)13-17;19-13-5-2-6-14-20-16-11-9-15(10-12-16)18(22)21-17-7-3-1-4-8-17;18-13-7-2-8-14-19-17-12-6-5-11-16(17)15-9-3-1-4-10-15;1-11(2)24(22,23)21-9-5-3-4-8-20-12-6-7-14(16)13(10-12)15(17,18)19;1-10-5-6-11(9-12(10)13)15-8-4-2-3-7-14;4*1-3(2)6(4)5/h8-13,16-17,23-24H,5-7,14-15H2,1-4H3;9-10,14,17-18,22H,6-8,11-13,21H2,1-5H3;10-13,16,18,20-21H,3-9,14-15H2,1-2H3;8-9,13-16,20-21H,5-7,10-12H2,1-4H3;9-12,17,20H,1-8,13-14,19H2,(H,21,22);15-17,19H,1-14,18H2;6-7,10-11,20-21H,3-5,8-9H2,1-2H3;5-6,9,15H,2-4,7-8,14H2,1H3;4*3H,1-2H3,(H,4,5)/p-4/t;14-,17-,18+;;;;;;;;;;/m.0........../s1.

What are the key properties of 4-(5-aminopentylamino)-N-cyclohexylbenzamide;N'-(2-cyclohexylcyclohexyl)pentane-1,5-diamine;N-[5-(4-cyclopentyloxyanilino)pentyl]propane-2-sulfonamide;N-[5-[(1,3-dimethyl-2,3-dihydro-1H-inden-5-yl)amino]pentyl]propane-2-sulfonamide;N-[5-[4-(3,4-dimethylphenyl)anilino]pentyl]propane-2-sulfonamide;N'-[2,3-dimethyl-4-[(2R,3S,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]pentane-1,5-diamine;N'-(3-fluoro-4-methylphenyl)pentane-1,5-diamine;N-[5-[4-fluoro-3-(trifluoromethyl)anilino]pentyl]propane-2-sulfonamide;tetrakis(propane-2-sulfinate)?

4-(5-aminopentylamino)-N-cyclohexylbenzamide;N'-(2-cyclohexylcyclohexyl)pentane-1,5-diamine;N-[5-(4-cyclopentyloxyanilino)pentyl]propane-2-sulfonamide;N-[5-[(1,3-dimethyl-2,3-dihydro-1H-inden-5-yl)amino]pentyl]propane-2-sulfonamide;N-[5-[4-(3,4-dimethylphenyl)anilino]pentyl]propane-2-sulfonamide;N'-[2,3-dimethyl-4-[(2R,3S,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]pentane-1,5-diamine;N'-(3-fluoro-4-methylphenyl)pentane-1,5-diamine;N-[5-[4-fluoro-3-(trifluoromethyl)anilino]pentyl]propane-2-sulfonamide;tetrakis(propane-2-sulfinate) has a molecular weight of 3022.43 g/mol, XLogP of 31.51, 71 rotatable bonds, 17 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(5-aminopentylamino)-N-cyclohexylbenzamide;N'-(2-cyclohexylcyclohexyl)pentane-1,5-diamine;N-[5-(4-cyclopentyloxyanilino)pentyl]propane-2-sulfonamide;N-[5-[(1,3-dimethyl-2,3-dihydro-1H-inden-5-yl)amino]pentyl]propane-2-sulfonamide;N-[5-[4-(3,4-dimethylphenyl)anilino]pentyl]propane-2-sulfonamide;N'-[2,3-dimethyl-4-[(2R,3S,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]pentane-1,5-diamine;N'-(3-fluoro-4-methylphenyl)pentane-1,5-diamine;N-[5-[4-fluoro-3-(trifluoromethyl)anilino]pentyl]propane-2-sulfonamide;tetrakis(propane-2-sulfinate) is sourced from PubChem (CID 157146306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).