N'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine

C302H612N20 — CID 159860734

IUPACN'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine
SMILESCCCCC/C=C\C/C=C\CCCCCCCCN(CCCCCCCCCCCC)CCN1CCN(CCN(CCCCCCCCCCCC)CCN(CCCCCCCCCCCC)CCCCCCCCCCCC)CC1.CCCCC/C=C\CCCCCN(CCCCC/C=C\CCCCC)CCN1CCN(CCN(CCCCCCCCCCCC)CCN(CCCCCCCCCCCC)CCCCCCCCCCCC)CC1.CCCCCCCC/C=C\CCCCCCCCN(CCCCCCCC/C=C\CCCCCCCC)CCN1CCN(CCN(CCCCCCCCCCCC)CCN(CCCCCCCCCCCC)CCCCCCCCCCCC)CC1.CCCCCCCCCCCCCCN(CCCCCCCCCCCCCC)CCN1CCN(CCN(CCCCCCCCCCCC)CCN(CCCCCCCCCCCC)CCCCCCCCCCCC)CC1
InChIInChI=1S/C82H165N5.C76H153N5.C74H153N5.C70H141N5/c1-6-11-16-21-26-31-36-38-40-42-44-46-51-55-60-65-70-84(71-66-61-56-52-47-45-43-41-39-37-32-27-22-17-12-7-2)74-77-86-79-81-87(82-80-86)78-76-85(72-67-62-57-50-35-30-25-20-15-10-5)75-73-83(68-63-58-53-48-33-28-23-18-13-8-3)69-64-59-54-49-34-29-24-19-14-9-4;1-6-11-16-21-26-31-36-37-38-39-40-41-46-50-55-60-65-78(64-59-54-49-44-34-29-24-19-14-9-4)68-71-80-73-75-81(76-74-80)72-70-79(66-61-56-51-45-35-30-25-20-15-10-5)69-67-77(62-57-52-47-42-32-27-22-17-12-7-2)63-58-53-48-43-33-28-23-18-13-8-3;1-6-11-16-21-26-31-36-38-43-47-52-57-62-76(63-58-53-48-44-39-37-32-27-22-17-12-7-2)66-69-78-71-73-79(74-72-78)70-68-77(64-59-54-49-42-35-30-25-20-15-10-5)67-65-75(60-55-50-45-40-33-28-23-18-13-8-3)61-56-51-46-41-34-29-24-19-14-9-4;1-6-11-16-21-26-31-36-41-46-51-56-71(57-52-47-42-37-32-27-22-17-12-7-2)61-63-73(60-55-50-45-40-35-30-25-20-15-10-5)64-66-75-69-67-74(68-70-75)65-62-72(58-53-48-43-38-33-28-23-18-13-8-3)59-54-49-44-39-34-29-24-19-14-9-4/h38-41H,6-37,42-82H2,1-5H3;26,31,37-38H,6-25,27-30,32-36,39-76H2,1-5H3;6-74H2,1-5H3;28-29,33-34H,6-27,30-32,35-70H2,1-5H3/b40-38-,41-39-;31-26-,38-37-;;33-28-,34-29-
InChIKeyNRCLPKQJNJIVAZ-SZJLBBBYSA-N
MW4524.36 g/mol
LogP91.70
Rot. Bonds272

About N'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine

N'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine (PubChem CID 159860734) has the molecular formula C302H612N20 and a molecular weight of 4524.36 g/mol. Its IUPAC name is N'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine
PubChem CID159860734
Molecular FormulaC302H612N20
Molecular Weight4524.36 g/mol
Exact Mass4520.85
IUPAC NameN'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine
SMILESCCCCC/C=C\C/C=C\CCCCCCCCN(CCCCCCCCCCCC)CCN1CCN(CCN(CCCCCCCCCCCC)CCN(CCCCCCCCCCCC)CCCCCCCCCCCC)CC1.CCCCC/C=C\CCCCCN(CCCCC/C=C\CCCCC)CCN1CCN(CCN(CCCCCCCCCCCC)CCN(CCCCCCCCCCCC)CCCCCCCCCCCC)CC1.CCCCCCCC/C=C\CCCCCCCCN(CCCCCCCC/C=C\CCCCCCCC)CCN1CCN(CCN(CCCCCCCCCCCC)CCN(CCCCCCCCCCCC)CCCCCCCCCCCC)CC1.CCCCCCCCCCCCCCN(CCCCCCCCCCCCCC)CCN1CCN(CCN(CCCCCCCCCCCC)CCN(CCCCCCCCCCCC)CCCCCCCCCCCC)CC1
InChIInChI=1S/C82H165N5.C76H153N5.C74H153N5.C70H141N5/c1-6-11-16-21-26-31-36-38-40-42-44-46-51-55-60-65-70-84(71-66-61-56-52-47-45-43-41-39-37-32-27-22-17-12-7-2)74-77-86-79-81-87(82-80-86)78-76-85(72-67-62-57-50-35-30-25-20-15-10-5)75-73-83(68-63-58-53-48-33-28-23-18-13-8-3)69-64-59-54-49-34-29-24-19-14-9-4;1-6-11-16-21-26-31-36-37-38-39-40-41-46-50-55-60-65-78(64-59-54-49-44-34-29-24-19-14-9-4)68-71-80-73-75-81(76-74-80)72-70-79(66-61-56-51-45-35-30-25-20-15-10-5)69-67-77(62-57-52-47-42-32-27-22-17-12-7-2)63-58-53-48-43-33-28-23-18-13-8-3;1-6-11-16-21-26-31-36-38-43-47-52-57-62-76(63-58-53-48-44-39-37-32-27-22-17-12-7-2)66-69-78-71-73-79(74-72-78)70-68-77(64-59-54-49-42-35-30-25-20-15-10-5)67-65-75(60-55-50-45-40-33-28-23-18-13-8-3)61-56-51-46-41-34-29-24-19-14-9-4;1-6-11-16-21-26-31-36-41-46-51-56-71(57-52-47-42-37-32-27-22-17-12-7-2)61-63-73(60-55-50-45-40-35-30-25-20-15-10-5)64-66-75-69-67-74(68-70-75)65-62-72(58-53-48-43-38-33-28-23-18-13-8-3)59-54-49-44-39-34-29-24-19-14-9-4/h38-41H,6-37,42-82H2,1-5H3;26,31,37-38H,6-25,27-30,32-36,39-76H2,1-5H3;6-74H2,1-5H3;28-29,33-34H,6-27,30-32,35-70H2,1-5H3/b40-38-,41-39-;31-26-,38-37-;;33-28-,34-29-
InChIKeyNRCLPKQJNJIVAZ-SZJLBBBYSA-N
XLogP91.70
TPSA64.80 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds272
Heavy Atoms322
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004524.36
LogP ≤ 591.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze N'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine with MolForge

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Launch Full Analysis

Related Compounds

1-[(6Z,9Z,28Z,31Z)-heptatriaconta-6,9,28,31-tetraen-19-yl]piperidine;1-[1-[(6Z,9Z,28Z,31Z)-heptatriaconta-6,9,28,31-tetraen-19-yl]piperidin-4-yl]-4-methylpiperazine;methane
CID 157153530
dilithium;1-[(2Z,6Z,9Z,13Z)-6-hexylidene-10-methanidyl-2,14-dimethyl-15-(4-methylpiperazin-1-yl)pentadeca-2,9,13-trienyl]-4-methylpiperazine;1-[(2Z,6Z)-6-methanidyl-2-methyldodeca-2,6-dienyl]-4-methylpiperazine;1-methyl-4-[(2Z)-2-methyl-6-methylideneocta-2,7-dienyl]piperazine
CID 157262097
N'-[2-[4-[2-(didodecylamino)ethyl]piperazin-1-yl]ethyl]-N,N,N'-tris[(9Z,12Z)-octadeca-9,12-dienyl]ethane-1,2-diamine;N'-[2-[4-[2-(didodecylamino)ethyl]piperazin-1-yl]ethyl]-N,N,N'-tris[(Z)-octadec-9-enyl]ethane-1,2-diamine
CID 158726899
N'-[2-[4-[2-[bis[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(nonyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tri(tetradecyl)ethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine
CID 158957331
N'-[2-[4-[2-[bis[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tris[(9Z,12Z)-octadeca-9,12-dienyl]ethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tris[(Z)-octadec-9-enyl]ethane-1,2-diamine;N'-[2-[4-[2-(dioctadecylamino)ethyl]piperazin-1-yl]ethyl]-N,N,N'-trioctadecylethane-1,2-diamine
CID 159762910
N'-[2-[4-[2-(didodecylamino)ethyl]piperazin-1-yl]ethyl]-N,N,N'-tris[(9Z,12Z)-octadeca-9,12-dienyl]ethane-1,2-diamine;N'-[2-[4-[2-(didodecylamino)ethyl]piperazin-1-yl]ethyl]-N,N,N'-tris[(Z)-octadec-9-enyl]ethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tri(tetradecyl)ethane-1,2-diamine
CID 160731211
(9Z,12Z)-N-[2-[4-[2-[bis[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]-N-methyloctadeca-9,12-dien-1-amine;(Z)-N-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N-methyloctadec-9-en-1-amine;N-[2-[4-[2-(dioctadecylamino)ethyl]piperazin-1-yl]ethyl]-N-methyloctadecan-1-amine;(9Z,12Z)-N-[(9Z,12Z)-octadeca-9,12-dienyl]-N-propyloctadeca-9,12-dien-1-amine;(Z)-N-[(Z)-octadec-9-enyl]-N-propyloctadec-9-en-1-amine;N-octadecyl-N-propyloctadecan-1-amine
CID 160736530
N'-[2-[4-[2-[bis[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-(didodecylamino)ethyl]piperazin-1-yl]ethyl]-N,N,N'-tri(tetradecyl)ethane-1,2-diamine;N'-[2-[4-[2-[di(nonyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tri(tetradecyl)ethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tri(tetradecyl)ethane-1,2-diamine
CID 162118326
N'-[2-[4-[2-(dihexylamino)ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(nonyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-(dioctylamino)ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[[(Z)-dodec-6-enyl]-dodecylamino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine
CID 162129934

Frequently Asked Questions

What is the IUPAC name of N'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine?
The IUPAC name of N'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine (CID 159860734) is N'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine.
What is the SMILES notation for N'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine?
The canonical SMILES for N'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine is CCCCC/C=C\C/C=C\CCCCCCCCN(CCCCCCCCCCCC)CCN1CCN(CCN(CCCCCCCCCCCC)CCN(CCCCCCCCCCCC)CCCCCCCCCCCC)CC1.CCCCC/C=C\CCCCCN(CCCCC/C=C\CCCCC)CCN1CCN(CCN(CCCCCCCCCCCC)CCN(CCCCCCCCCCCC)CCCCCCCCCCCC)CC1.CCCCCCCC/C=C\CCCCCCCCN(CCCCCCCC/C=C\CCCCCCCC)CCN1CCN(CCN(CCCCCCCCCCCC)CCN(CCCCCCCCCCCC)CCCCCCCCCCCC)CC1.CCCCCCCCCCCCCCN(CCCCCCCCCCCCCC)CCN1CCN(CCN(CCCCCCCCCCCC)CCN(CCCCCCCCCCCC)CCCCCCCCCCCC)CC1.
What is the InChIKey of N'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine?
The InChIKey is NRCLPKQJNJIVAZ-SZJLBBBYSA-N. The full InChI is InChI=1S/C82H165N5.C76H153N5.C74H153N5.C70H141N5/c1-6-11-16-21-26-31-36-38-40-42-44-46-51-55-60-65-70-84(71-66-61-56-52-47-45-43-41-39-37-32-27-22-17-12-7-2)74-77-86-79-81-87(82-80-86)78-76-85(72-67-62-57-50-35-30-25-20-15-10-5)75-73-83(68-63-58-53-48-33-28-23-18-13-8-3)69-64-59-54-49-34-29-24-19-14-9-4;1-6-11-16-21-26-31-36-37-38-39-40-41-46-50-55-60-65-78(64-59-54-49-44-34-29-24-19-14-9-4)68-71-80-73-75-81(76-74-80)72-70-79(66-61-56-51-45-35-30-25-20-15-10-5)69-67-77(62-57-52-47-42-32-27-22-17-12-7-2)63-58-53-48-43-33-28-23-18-13-8-3;1-6-11-16-21-26-31-36-38-43-47-52-57-62-76(63-58-53-48-44-39-37-32-27-22-17-12-7-2)66-69-78-71-73-79(74-72-78)70-68-77(64-59-54-49-42-35-30-25-20-15-10-5)67-65-75(60-55-50-45-40-33-28-23-18-13-8-3)61-56-51-46-41-34-29-24-19-14-9-4;1-6-11-16-21-26-31-36-41-46-51-56-71(57-52-47-42-37-32-27-22-17-12-7-2)61-63-73(60-55-50-45-40-35-30-25-20-15-10-5)64-66-75-69-67-74(68-70-75)65-62-72(58-53-48-43-38-33-28-23-18-13-8-3)59-54-49-44-39-34-29-24-19-14-9-4/h38-41H,6-37,42-82H2,1-5H3;26,31,37-38H,6-25,27-30,32-36,39-76H2,1-5H3;6-74H2,1-5H3;28-29,33-34H,6-27,30-32,35-70H2,1-5H3/b40-38-,41-39-;31-26-,38-37-;;33-28-,34-29-.
What are the key properties of N'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine?
N'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine has a molecular weight of 4524.36 g/mol, XLogP of 91.70, 272 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-[4-[2-[bis[(Z)-dodec-6-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[bis[(Z)-octadec-9-enyl]amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N'-[2-[4-[2-[di(tetradecyl)amino]ethyl]piperazin-1-yl]ethyl]-N,N,N'-tridodecylethane-1,2-diamine;N,N,N'-tridodecyl-N'-[2-[4-[2-[dodecyl-[(9Z,12Z)-octadeca-9,12-dienyl]amino]ethyl]piperazin-1-yl]ethyl]ethane-1,2-diamine is sourced from PubChem (CID 159860734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).