N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propyl]propane-1,3-diamine;N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[(2E)-2-methyl-6-methylideneocta-2,7-dienyl]propane-1,3-diamine;N,N-dimethyl-2-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethoxy]ethanamine;N,N-dimethyl-3-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propan-1-amine;N,N,N'-trimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethyl]ethane-1,2-diamine

C91H172N10O5 — CID 160753914

About N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propyl]propane-1,3-diamine;N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[(2E)-2-methyl-6-methylideneocta-2,7-dienyl]propane-1,3-diamine;N,N-dimethyl-2-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethoxy]ethanamine;N,N-dimethyl-3-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propan-1-amine;N,N,N'-trimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethyl]ethane-1,2-diamine

N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propyl]propane-1,3-diamine;N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[(2E)-2-methyl-6-methylideneocta-2,7-dienyl]propane-1,3-diamine;N,N-dimethyl-2-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethoxy]ethanamine;N,N-dimethyl-3-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propan-1-amine;N,N,N'-trimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethyl]ethane-1,2-diamine (PubChem CID 160753914) has the molecular formula C91H172N10O5 and a molecular weight of 1486.44 g/mol. Its IUPAC name is N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propyl]propane-1,3-diamine;N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[(2E)-2-methyl-6-methylideneocta-2,7-dienyl]propane-1,3-diamine;N,N-dimethyl-2-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethoxy]ethanamine;N,N-dimethyl-3-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propan-1-amine;N,N,N'-trimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethyl]ethane-1,2-diamine.

Molecular Properties

• Compound Name: N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propyl]propane-1,3-diamine;N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[(2E)-2-methyl-6-methylideneocta-2,7-dienyl]propane-1,3-diamine;N,N-dimethyl-2-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethoxy]ethanamine;N,N-dimethyl-3-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propan-1-amine;N,N,N'-trimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethyl]ethane-1,2-diamine
• PubChem CID: 160753914
• Molecular Formula: C91H172N10O5
• Molecular Weight: 1486.44 g/mol
• Exact Mass: 1485.35
• IUPAC Name: N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propyl]propane-1,3-diamine;N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[(2E)-2-methyl-6-methylideneocta-2,7-dienyl]propane-1,3-diamine;N,N-dimethyl-2-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethoxy]ethanamine;N,N-dimethyl-3-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propan-1-amine;N,N,N'-trimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethyl]ethane-1,2-diamine
• SMILES: C=CC(=C)CC/C=C(\C)CN(CCCN(C)C)CCCN(C)C.C=CC(=C)CC/C=C(\C)COC(C)CN(CCCN(C)C)CCCN(C)C.C=CC(=C)CC/C=C(\C)COCCCN(C)C.C=CC(=C)CC/C=C(\C)COCCN(C)CCN(C)C.C=CC(=C)CC/C=C(\C)COCCOCCN(C)C
• InChI: InChI=1S/C23H45N3O.C20H39N3.C17H32N2O.C16H29NO2.C15H27NO/c1-9-21(2)13-10-14-22(3)20-27-23(4)19-26(17-11-15-24(5)6)18-12-16-25(7)8;1-8-19(2)12-9-13-20(3)18-23(16-10-14-21(4)5)17-11-15-22(6)7;1-7-16(2)9-8-10-17(3)15-20-14-13-19(6)12-11-18(4)5;1-6-15(2)8-7-9-16(3)14-19-13-12-18-11-10-17(4)5;1-6-14(2)9-7-10-15(3)13-17-12-8-11-16(4)5/h9,14,23H,1-2,10-13,15-20H2,3-8H3;8,13H,1-2,9-12,14-18H2,3-7H3;7,10H,1-2,8-9,11-15H2,3-6H3;6,9H,1-2,7-8,10-14H2,3-5H3;6,10H,1-2,7-9,11-13H2,3-5H3/b22-14+;20-13+;17-10+;16-9+;15-10+
• InChIKey: RXEGEZOUGBSWNX-DNJBJQIFSA-N
• XLogP: 17.16
• TPSA: 78.55 Ų
• H-Bond Acceptors: 15
• Rotatable Bonds: 65
• Heavy Atoms: 106
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1486.44
LogP ≤ 5	17.16
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propyl]propane-1,3-diamine;N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[(2E)-2-methyl-6-methylideneocta-2,7-dienyl]propane-1,3-diamine;N,N-dimethyl-2-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethoxy]ethanamine;N,N-dimethyl-3-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propan-1-amine;N,N,N'-trimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethyl]ethane-1,2-diamine?

The IUPAC name of N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propyl]propane-1,3-diamine;N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[(2E)-2-methyl-6-methylideneocta-2,7-dienyl]propane-1,3-diamine;N,N-dimethyl-2-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethoxy]ethanamine;N,N-dimethyl-3-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propan-1-amine;N,N,N'-trimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethyl]ethane-1,2-diamine (CID 160753914) is N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propyl]propane-1,3-diamine;N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[(2E)-2-methyl-6-methylideneocta-2,7-dienyl]propane-1,3-diamine;N,N-dimethyl-2-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethoxy]ethanamine;N,N-dimethyl-3-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propan-1-amine;N,N,N'-trimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethyl]ethane-1,2-diamine.

What is the SMILES notation for N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propyl]propane-1,3-diamine;N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[(2E)-2-methyl-6-methylideneocta-2,7-dienyl]propane-1,3-diamine;N,N-dimethyl-2-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethoxy]ethanamine;N,N-dimethyl-3-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propan-1-amine;N,N,N'-trimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethyl]ethane-1,2-diamine?

The canonical SMILES for N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propyl]propane-1,3-diamine;N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[(2E)-2-methyl-6-methylideneocta-2,7-dienyl]propane-1,3-diamine;N,N-dimethyl-2-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethoxy]ethanamine;N,N-dimethyl-3-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propan-1-amine;N,N,N'-trimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethyl]ethane-1,2-diamine is C=CC(=C)CC/C=C(\C)CN(CCCN(C)C)CCCN(C)C.C=CC(=C)CC/C=C(\C)COC(C)CN(CCCN(C)C)CCCN(C)C.C=CC(=C)CC/C=C(\C)COCCCN(C)C.C=CC(=C)CC/C=C(\C)COCCN(C)CCN(C)C.C=CC(=C)CC/C=C(\C)COCCOCCN(C)C.

What is the InChIKey of N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propyl]propane-1,3-diamine;N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[(2E)-2-methyl-6-methylideneocta-2,7-dienyl]propane-1,3-diamine;N,N-dimethyl-2-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethoxy]ethanamine;N,N-dimethyl-3-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propan-1-amine;N,N,N'-trimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethyl]ethane-1,2-diamine?

The InChIKey is RXEGEZOUGBSWNX-DNJBJQIFSA-N. The full InChI is InChI=1S/C23H45N3O.C20H39N3.C17H32N2O.C16H29NO2.C15H27NO/c1-9-21(2)13-10-14-22(3)20-27-23(4)19-26(17-11-15-24(5)6)18-12-16-25(7)8;1-8-19(2)12-9-13-20(3)18-23(16-10-14-21(4)5)17-11-15-22(6)7;1-7-16(2)9-8-10-17(3)15-20-14-13-19(6)12-11-18(4)5;1-6-15(2)8-7-9-16(3)14-19-13-12-18-11-10-17(4)5;1-6-14(2)9-7-10-15(3)13-17-12-8-11-16(4)5/h9,14,23H,1-2,10-13,15-20H2,3-8H3;8,13H,1-2,9-12,14-18H2,3-7H3;7,10H,1-2,8-9,11-15H2,3-6H3;6,9H,1-2,7-8,10-14H2,3-5H3;6,10H,1-2,7-9,11-13H2,3-5H3/b22-14+;20-13+;17-10+;16-9+;15-10+.

What are the key properties of N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propyl]propane-1,3-diamine;N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[(2E)-2-methyl-6-methylideneocta-2,7-dienyl]propane-1,3-diamine;N,N-dimethyl-2-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethoxy]ethanamine;N,N-dimethyl-3-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propan-1-amine;N,N,N'-trimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethyl]ethane-1,2-diamine?

N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propyl]propane-1,3-diamine;N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[(2E)-2-methyl-6-methylideneocta-2,7-dienyl]propane-1,3-diamine;N,N-dimethyl-2-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethoxy]ethanamine;N,N-dimethyl-3-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propan-1-amine;N,N,N'-trimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethyl]ethane-1,2-diamine has a molecular weight of 1486.44 g/mol, XLogP of 17.16, 65 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propyl]propane-1,3-diamine;N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-[(2E)-2-methyl-6-methylideneocta-2,7-dienyl]propane-1,3-diamine;N,N-dimethyl-2-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethoxy]ethanamine;N,N-dimethyl-3-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]propan-1-amine;N,N,N'-trimethyl-N'-[2-[(2E)-2-methyl-6-methylideneocta-2,7-dienoxy]ethyl]ethane-1,2-diamine is sourced from PubChem (CID 160753914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).