2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanamine;2-(2-aminoethyldisulfanyl)ethanamine;2-[(2-aminophenyl)disulfanyl]aniline;4-[(4-aminophenyl)disulfanyl]aniline;2-(3-aminopropylamino)ethanol;2,2-bis(prop-2-enoyloxymethyl)butyl benzoate;2,2-dimethylpropane-1,3-diamine;2-(1H-imidazol-5-yl)ethanamine;3-imidazol-1-ylpropan-1-amine;2-methylpentane-1,5-diamine;3-(4-methylpiperazin-1-yl)propan-1-amine;pentane-1,3-diamine;propane-1,3-diamine;prop-2-enal;2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate;2-[2-(6-prop-2-enoyloxyhexanoyloxy)ethoxy]ethyl 6-hydroxyhexanoate

C136H247N27O25S6 — CID 159223896

About 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanamine;2-(2-aminoethyldisulfanyl)ethanamine;2-[(2-aminophenyl)disulfanyl]aniline;4-[(4-aminophenyl)disulfanyl]aniline;2-(3-aminopropylamino)ethanol;2,2-bis(prop-2-enoyloxymethyl)butyl benzoate;2,2-dimethylpropane-1,3-diamine;2-(1H-imidazol-5-yl)ethanamine;3-imidazol-1-ylpropan-1-amine;2-methylpentane-1,5-diamine;3-(4-methylpiperazin-1-yl)propan-1-amine;pentane-1,3-diamine;propane-1,3-diamine;prop-2-enal;2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate;2-[2-(6-prop-2-enoyloxyhexanoyloxy)ethoxy]ethyl 6-hydroxyhexanoate

2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanamine;2-(2-aminoethyldisulfanyl)ethanamine;2-[(2-aminophenyl)disulfanyl]aniline;4-[(4-aminophenyl)disulfanyl]aniline;2-(3-aminopropylamino)ethanol;2,2-bis(prop-2-enoyloxymethyl)butyl benzoate;2,2-dimethylpropane-1,3-diamine;2-(1H-imidazol-5-yl)ethanamine;3-imidazol-1-ylpropan-1-amine;2-methylpentane-1,5-diamine;3-(4-methylpiperazin-1-yl)propan-1-amine;pentane-1,3-diamine;propane-1,3-diamine;prop-2-enal;2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate;2-[2-(6-prop-2-enoyloxyhexanoyloxy)ethoxy]ethyl 6-hydroxyhexanoate (PubChem CID 159223896) has the molecular formula C136H247N27O25S6 and a molecular weight of 2853.04 g/mol. Its IUPAC name is 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanamine;2-(2-aminoethyldisulfanyl)ethanamine;2-[(2-aminophenyl)disulfanyl]aniline;4-[(4-aminophenyl)disulfanyl]aniline;2-(3-aminopropylamino)ethanol;2,2-bis(prop-2-enoyloxymethyl)butyl benzoate;2,2-dimethylpropane-1,3-diamine;2-(1H-imidazol-5-yl)ethanamine;3-imidazol-1-ylpropan-1-amine;2-methylpentane-1,5-diamine;3-(4-methylpiperazin-1-yl)propan-1-amine;pentane-1,3-diamine;propane-1,3-diamine;prop-2-enal;2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate;2-[2-(6-prop-2-enoyloxyhexanoyloxy)ethoxy]ethyl 6-hydroxyhexanoate.

Molecular Properties

• Compound Name: 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanamine;2-(2-aminoethyldisulfanyl)ethanamine;2-[(2-aminophenyl)disulfanyl]aniline;4-[(4-aminophenyl)disulfanyl]aniline;2-(3-aminopropylamino)ethanol;2,2-bis(prop-2-enoyloxymethyl)butyl benzoate;2,2-dimethylpropane-1,3-diamine;2-(1H-imidazol-5-yl)ethanamine;3-imidazol-1-ylpropan-1-amine;2-methylpentane-1,5-diamine;3-(4-methylpiperazin-1-yl)propan-1-amine;pentane-1,3-diamine;propane-1,3-diamine;prop-2-enal;2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate;2-[2-(6-prop-2-enoyloxyhexanoyloxy)ethoxy]ethyl 6-hydroxyhexanoate
• PubChem CID: 159223896
• Molecular Formula: C136H247N27O25S6
• Molecular Weight: 2853.04 g/mol
• Exact Mass: 2850.72
• IUPAC Name: 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanamine;2-(2-aminoethyldisulfanyl)ethanamine;2-[(2-aminophenyl)disulfanyl]aniline;4-[(4-aminophenyl)disulfanyl]aniline;2-(3-aminopropylamino)ethanol;2,2-bis(prop-2-enoyloxymethyl)butyl benzoate;2,2-dimethylpropane-1,3-diamine;2-(1H-imidazol-5-yl)ethanamine;3-imidazol-1-ylpropan-1-amine;2-methylpentane-1,5-diamine;3-(4-methylpiperazin-1-yl)propan-1-amine;pentane-1,3-diamine;propane-1,3-diamine;prop-2-enal;2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate;2-[2-(6-prop-2-enoyloxyhexanoyloxy)ethoxy]ethyl 6-hydroxyhexanoate
• SMILES: C=CC(=O)OCC(CC)(COC(=O)C=C)COC(=O)c1ccccc1.C=CC(=O)OCCCCCC(=O)OCCOCCOC(=O)CCCCCO.C=CC(=O)OCCOCCCCCCOCCOC(=O)C=C.C=CC=O.CC(C)(CN)CN.CC(CN)CCCN.CCC(N)CCN.CN1CCN(CCCN)CC1.NCCCN.NCCCNCCO.NCCCn1ccnc1.NCCOCCOCCOCCN.NCCSSCCN.NCCc1cnc[nH]1.Nc1ccc(SSc2ccc(N)cc2)cc1.Nc1ccccc1SSc1ccccc1N
• InChI: InChI=1S/C19H32O8.C19H22O6.C16H26O6.2C12H12N2S2.C8H19N3.C8H20N2O3.C6H11N3.C6H16N2.C5H9N3.C5H14N2O.2C5H14N2.C4H12N2S2.C3H10N2.C3H4O/c1-2-17(21)25-12-8-4-6-10-19(23)27-16-14-24-13-15-26-18(22)9-5-3-7-11-20;1-4-16(20)23-12-19(6-3,13-24-17(21)5-2)14-25-18(22)15-10-8-7-9-11-15;1-3-15(17)21-13-11-19-9-7-5-6-8-10-20-12-14-22-16(18)4-2;13-9-1-5-11(6-2-9)15-16-12-7-3-10(14)4-8-12;13-9-5-1-3-7-11(9)15-16-12-8-4-2-6-10(12)14;1-10-5-7-11(8-6-10)4-2-3-9;9-1-3-11-5-7-13-8-6-12-4-2-10;7-2-1-4-9-5-3-8-6-9;1-6(5-8)3-2-4-7;6-2-1-5-3-7-4-8-5;6-2-1-3-7-4-5-8;1-5(2,3-6)4-7;1-2-5(7)3-4-6;5-1-3-7-8-4-2-6;4-2-1-3-5;1-2-3-4/h2,20H,1,3-16H2;4-5,7-11H,1-2,6,12-14H2,3H3;3-4H,1-2,5-14H2;2*1-8H,13-14H2;2-9H2,1H3;1-10H2;3,5-6H,1-2,4,7H2;6H,2-5,7-8H2,1H3;3-4H,1-2,6H2,(H,7,8);7-8H,1-6H2;3-4,6-7H2,1-2H3;5H,2-4,6-7H2,1H3;1-6H2;1-5H2;2-3H,1H2
• InChIKey: KSAQLAZOMSAXGH-UHFFFAOYSA-N
• XLogP: 11.84
• TPSA: 908.72 Ų
• H-Bond Donors: 24
• H-Bond Acceptors: 57
• Rotatable Bonds: 89
• Heavy Atoms: 194
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2853.04
LogP ≤ 5	11.84
H-Bond Donors ≤ 5	24
H-Bond Acceptors ≤ 10	57

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanamine;2-(2-aminoethyldisulfanyl)ethanamine;2-[(2-aminophenyl)disulfanyl]aniline;4-[(4-aminophenyl)disulfanyl]aniline;2-(3-aminopropylamino)ethanol;2,2-bis(prop-2-enoyloxymethyl)butyl benzoate;2,2-dimethylpropane-1,3-diamine;2-(1H-imidazol-5-yl)ethanamine;3-imidazol-1-ylpropan-1-amine;2-methylpentane-1,5-diamine;3-(4-methylpiperazin-1-yl)propan-1-amine;pentane-1,3-diamine;propane-1,3-diamine;prop-2-enal;2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate;2-[2-(6-prop-2-enoyloxyhexanoyloxy)ethoxy]ethyl 6-hydroxyhexanoate?

The IUPAC name of 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanamine;2-(2-aminoethyldisulfanyl)ethanamine;2-[(2-aminophenyl)disulfanyl]aniline;4-[(4-aminophenyl)disulfanyl]aniline;2-(3-aminopropylamino)ethanol;2,2-bis(prop-2-enoyloxymethyl)butyl benzoate;2,2-dimethylpropane-1,3-diamine;2-(1H-imidazol-5-yl)ethanamine;3-imidazol-1-ylpropan-1-amine;2-methylpentane-1,5-diamine;3-(4-methylpiperazin-1-yl)propan-1-amine;pentane-1,3-diamine;propane-1,3-diamine;prop-2-enal;2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate;2-[2-(6-prop-2-enoyloxyhexanoyloxy)ethoxy]ethyl 6-hydroxyhexanoate (CID 159223896) is 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanamine;2-(2-aminoethyldisulfanyl)ethanamine;2-[(2-aminophenyl)disulfanyl]aniline;4-[(4-aminophenyl)disulfanyl]aniline;2-(3-aminopropylamino)ethanol;2,2-bis(prop-2-enoyloxymethyl)butyl benzoate;2,2-dimethylpropane-1,3-diamine;2-(1H-imidazol-5-yl)ethanamine;3-imidazol-1-ylpropan-1-amine;2-methylpentane-1,5-diamine;3-(4-methylpiperazin-1-yl)propan-1-amine;pentane-1,3-diamine;propane-1,3-diamine;prop-2-enal;2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate;2-[2-(6-prop-2-enoyloxyhexanoyloxy)ethoxy]ethyl 6-hydroxyhexanoate.

What is the SMILES notation for 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanamine;2-(2-aminoethyldisulfanyl)ethanamine;2-[(2-aminophenyl)disulfanyl]aniline;4-[(4-aminophenyl)disulfanyl]aniline;2-(3-aminopropylamino)ethanol;2,2-bis(prop-2-enoyloxymethyl)butyl benzoate;2,2-dimethylpropane-1,3-diamine;2-(1H-imidazol-5-yl)ethanamine;3-imidazol-1-ylpropan-1-amine;2-methylpentane-1,5-diamine;3-(4-methylpiperazin-1-yl)propan-1-amine;pentane-1,3-diamine;propane-1,3-diamine;prop-2-enal;2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate;2-[2-(6-prop-2-enoyloxyhexanoyloxy)ethoxy]ethyl 6-hydroxyhexanoate?

The canonical SMILES for 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanamine;2-(2-aminoethyldisulfanyl)ethanamine;2-[(2-aminophenyl)disulfanyl]aniline;4-[(4-aminophenyl)disulfanyl]aniline;2-(3-aminopropylamino)ethanol;2,2-bis(prop-2-enoyloxymethyl)butyl benzoate;2,2-dimethylpropane-1,3-diamine;2-(1H-imidazol-5-yl)ethanamine;3-imidazol-1-ylpropan-1-amine;2-methylpentane-1,5-diamine;3-(4-methylpiperazin-1-yl)propan-1-amine;pentane-1,3-diamine;propane-1,3-diamine;prop-2-enal;2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate;2-[2-(6-prop-2-enoyloxyhexanoyloxy)ethoxy]ethyl 6-hydroxyhexanoate is C=CC(=O)OCC(CC)(COC(=O)C=C)COC(=O)c1ccccc1.C=CC(=O)OCCCCCC(=O)OCCOCCOC(=O)CCCCCO.C=CC(=O)OCCOCCCCCCOCCOC(=O)C=C.C=CC=O.CC(C)(CN)CN.CC(CN)CCCN.CCC(N)CCN.CN1CCN(CCCN)CC1.NCCCN.NCCCNCCO.NCCCn1ccnc1.NCCOCCOCCOCCN.NCCSSCCN.NCCc1cnc[nH]1.Nc1ccc(SSc2ccc(N)cc2)cc1.Nc1ccccc1SSc1ccccc1N.

What is the InChIKey of 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanamine;2-(2-aminoethyldisulfanyl)ethanamine;2-[(2-aminophenyl)disulfanyl]aniline;4-[(4-aminophenyl)disulfanyl]aniline;2-(3-aminopropylamino)ethanol;2,2-bis(prop-2-enoyloxymethyl)butyl benzoate;2,2-dimethylpropane-1,3-diamine;2-(1H-imidazol-5-yl)ethanamine;3-imidazol-1-ylpropan-1-amine;2-methylpentane-1,5-diamine;3-(4-methylpiperazin-1-yl)propan-1-amine;pentane-1,3-diamine;propane-1,3-diamine;prop-2-enal;2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate;2-[2-(6-prop-2-enoyloxyhexanoyloxy)ethoxy]ethyl 6-hydroxyhexanoate?

The InChIKey is KSAQLAZOMSAXGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32O8.C19H22O6.C16H26O6.2C12H12N2S2.C8H19N3.C8H20N2O3.C6H11N3.C6H16N2.C5H9N3.C5H14N2O.2C5H14N2.C4H12N2S2.C3H10N2.C3H4O/c1-2-17(21)25-12-8-4-6-10-19(23)27-16-14-24-13-15-26-18(22)9-5-3-7-11-20;1-4-16(20)23-12-19(6-3,13-24-17(21)5-2)14-25-18(22)15-10-8-7-9-11-15;1-3-15(17)21-13-11-19-9-7-5-6-8-10-20-12-14-22-16(18)4-2;13-9-1-5-11(6-2-9)15-16-12-7-3-10(14)4-8-12;13-9-5-1-3-7-11(9)15-16-12-8-4-2-6-10(12)14;1-10-5-7-11(8-6-10)4-2-3-9;9-1-3-11-5-7-13-8-6-12-4-2-10;7-2-1-4-9-5-3-8-6-9;1-6(5-8)3-2-4-7;6-2-1-5-3-7-4-8-5;6-2-1-3-7-4-5-8;1-5(2,3-6)4-7;1-2-5(7)3-4-6;5-1-3-7-8-4-2-6;4-2-1-3-5;1-2-3-4/h2,20H,1,3-16H2;4-5,7-11H,1-2,6,12-14H2,3H3;3-4H,1-2,5-14H2;2*1-8H,13-14H2;2-9H2,1H3;1-10H2;3,5-6H,1-2,4,7H2;6H,2-5,7-8H2,1H3;3-4H,1-2,6H2,(H,7,8);7-8H,1-6H2;3-4,6-7H2,1-2H3;5H,2-4,6-7H2,1H3;1-6H2;1-5H2;2-3H,1H2.

What are the key properties of 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanamine;2-(2-aminoethyldisulfanyl)ethanamine;2-[(2-aminophenyl)disulfanyl]aniline;4-[(4-aminophenyl)disulfanyl]aniline;2-(3-aminopropylamino)ethanol;2,2-bis(prop-2-enoyloxymethyl)butyl benzoate;2,2-dimethylpropane-1,3-diamine;2-(1H-imidazol-5-yl)ethanamine;3-imidazol-1-ylpropan-1-amine;2-methylpentane-1,5-diamine;3-(4-methylpiperazin-1-yl)propan-1-amine;pentane-1,3-diamine;propane-1,3-diamine;prop-2-enal;2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate;2-[2-(6-prop-2-enoyloxyhexanoyloxy)ethoxy]ethyl 6-hydroxyhexanoate?

2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanamine;2-(2-aminoethyldisulfanyl)ethanamine;2-[(2-aminophenyl)disulfanyl]aniline;4-[(4-aminophenyl)disulfanyl]aniline;2-(3-aminopropylamino)ethanol;2,2-bis(prop-2-enoyloxymethyl)butyl benzoate;2,2-dimethylpropane-1,3-diamine;2-(1H-imidazol-5-yl)ethanamine;3-imidazol-1-ylpropan-1-amine;2-methylpentane-1,5-diamine;3-(4-methylpiperazin-1-yl)propan-1-amine;pentane-1,3-diamine;propane-1,3-diamine;prop-2-enal;2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate;2-[2-(6-prop-2-enoyloxyhexanoyloxy)ethoxy]ethyl 6-hydroxyhexanoate has a molecular weight of 2853.04 g/mol, XLogP of 11.84, 89 rotatable bonds, 24 hydrogen bond donors, and 57 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanamine;2-(2-aminoethyldisulfanyl)ethanamine;2-[(2-aminophenyl)disulfanyl]aniline;4-[(4-aminophenyl)disulfanyl]aniline;2-(3-aminopropylamino)ethanol;2,2-bis(prop-2-enoyloxymethyl)butyl benzoate;2,2-dimethylpropane-1,3-diamine;2-(1H-imidazol-5-yl)ethanamine;3-imidazol-1-ylpropan-1-amine;2-methylpentane-1,5-diamine;3-(4-methylpiperazin-1-yl)propan-1-amine;pentane-1,3-diamine;propane-1,3-diamine;prop-2-enal;2-[6-(2-prop-2-enoyloxyethoxy)hexoxy]ethyl prop-2-enoate;2-[2-(6-prop-2-enoyloxyhexanoyloxy)ethoxy]ethyl 6-hydroxyhexanoate is sourced from PubChem (CID 159223896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).