N'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine

C218H448N32O7 — CID 176521361

IUPACN'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine
SMILESCCCCCCCC/C=C\CCCCCCCCN(CCCNC(=O)C(CCCNCCCN)NCCCN)CCOCCOCCN(CCCCCCCC/C=C\CCCCCCCC)CCCNC(=O)C(CCCNCCCN)NCCCN.CCCCCCCCC=CCCCCCCCCN(CCCN)CCOCCOCCOCCN(CCCN)CCCCCCCCC=CCCCCCCCC.[H]/N=C(\N)NCC(C)CN(CCCCCCCCC=CCCCCCCCC)CCCCN(CCCCCCCCC=CCCCCCCCC)CC(C)CN=C(N)N.[H]/N=C(\N)NCCCN(CCCCCCCCC=CCCCCCCCC)CCCCN(CCCCCCCCC=CCCCCCCCC)CCCN=C(N)N
InChIInChI=1S/C70H146N12O4.C50H102N8.C50H102N4O3.C48H98N8/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-57-81(59-41-55-79-69(83)67(77-53-39-47-73)43-35-49-75-51-37-45-71)61-63-85-65-66-86-64-62-82(58-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)60-42-56-80-70(84)68(78-54-40-48-74)44-36-50-76-52-38-46-72;1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39-57(45-47(3)43-55-49(51)52)41-37-38-42-58(46-48(4)44-56-50(53)54)40-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39-53(41-35-37-51)43-45-55-47-49-57-50-48-56-46-44-54(42-36-38-52)40-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41-55(45-37-39-53-47(49)50)43-35-36-44-56(46-38-40-54-48(51)52)42-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,67-68,75-78H,3-16,21-66,71-74H2,1-2H3,(H,79,83)(H,80,84);19-22,47-48H,5-18,23-46H2,1-4H3,(H4,51,52,55)(H4,53,54,56);17-20H,3-16,21-52H2,1-2H3;17-20H,3-16,21-46H2,1-2H3,(H4,49,50,53)(H4,51,52,54)/b19-17-,20-18-;;;
InChIKeyLNHLILBDFBRFIN-SUGRRRODSA-N
MW3630.20 g/mol
LogP47.63
Rot. Bonds213

About N'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine

N'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine (PubChem CID 176521361) has the molecular formula C218H448N32O7 and a molecular weight of 3630.20 g/mol. Its IUPAC name is N'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine.

Molecular Properties

Compound NameN'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine
PubChem CID176521361
Molecular FormulaC218H448N32O7
Molecular Weight3630.20 g/mol
Exact Mass3627.57
IUPAC NameN'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine
SMILESCCCCCCCC/C=C\CCCCCCCCN(CCCNC(=O)C(CCCNCCCN)NCCCN)CCOCCOCCN(CCCCCCCC/C=C\CCCCCCCC)CCCNC(=O)C(CCCNCCCN)NCCCN.CCCCCCCCC=CCCCCCCCCN(CCCN)CCOCCOCCOCCN(CCCN)CCCCCCCCC=CCCCCCCCC.[H]/N=C(\N)NCC(C)CN(CCCCCCCCC=CCCCCCCCC)CCCCN(CCCCCCCCC=CCCCCCCCC)CC(C)CN=C(N)N.[H]/N=C(\N)NCCCN(CCCCCCCCC=CCCCCCCCC)CCCCN(CCCCCCCCC=CCCCCCCCC)CCCN=C(N)N
InChIInChI=1S/C70H146N12O4.C50H102N8.C50H102N4O3.C48H98N8/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-57-81(59-41-55-79-69(83)67(77-53-39-47-73)43-35-49-75-51-37-45-71)61-63-85-65-66-86-64-62-82(58-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)60-42-56-80-70(84)68(78-54-40-48-74)44-36-50-76-52-38-46-72;1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39-57(45-47(3)43-55-49(51)52)41-37-38-42-58(46-48(4)44-56-50(53)54)40-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39-53(41-35-37-51)43-45-55-47-49-57-50-48-56-46-44-54(42-36-38-52)40-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41-55(45-37-39-53-47(49)50)43-35-36-44-56(46-38-40-54-48(51)52)42-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,67-68,75-78H,3-16,21-66,71-74H2,1-2H3,(H,79,83)(H,80,84);19-22,47-48H,5-18,23-46H2,1-4H3,(H4,51,52,55)(H4,53,54,56);17-20H,3-16,21-52H2,1-2H3;17-20H,3-16,21-46H2,1-2H3,(H4,49,50,53)(H4,51,52,54)/b19-17-,20-18-;;;
InChIKeyLNHLILBDFBRFIN-SUGRRRODSA-N
XLogP47.63
TPSA587.11 Ų
H-Bond Donors22
H-Bond Acceptors29
Rotatable Bonds213
Heavy Atoms257
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003630.20
LogP ≤ 547.63
H-Bond Donors ≤ 522
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine with MolForge

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Related Compounds

1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine;1-[3-[2-[2-[2-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]ethoxy]ethoxy]ethyl-octadec-9-enylamino]propyl]guanidine;trimethyl-[3-[methyl-octadec-9-enyl-[2-[octadec-9-enyl-[3-(trimethylazaniumyl)propyl]azaniumyl]ethyl]azaniumyl]propyl]azanium
CID 176542028
1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-[(E)-octadec-9-enyl]amino]butyl-[(Z)-octadec-9-enyl]amino]-2-methylpropyl]guanidine
CID 176526595
5-(3-aminopropylamino)-N-[3-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethyl-[(Z)-octadec-9-enyl]amino]propyl]-2-(butylamino)pentanamide
CID 90939214
5-(4-aminobutylamino)-2-(3-aminopropylamino)-N-[3-[2-[[3-[2,5-bis(3-aminopropylamino)pentanoylamino]-2-methylpropyl]-octadec-9-enylamino]ethyl-octadec-9-enylamino]-2-methylpropyl]pentanamide;2,5-bis(3-aminopropylamino)-N-[3-[4-[[3-[2,5-bis(3-aminopropylamino)pentanoylamino]-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]pentanamide;[4-[2,5-bis(3-aminopropylamino)pentanoylamino]-3-methylbutyl]-[4-[[3-[2,5-bis(3-aminopropylamino)pentanoylamino]-2-methylpropyl]-methyl-[(E)-octadec-9-enyl]azaniumyl]butyl]-methyl-octadec-9-enylazanium
CID 159687020
1-amino-3-[4-[(3-amino-2-hydroxypropyl)-[(E)-octadec-9-enyl]amino]butyl-[(Z)-octadec-9-enyl]amino]propan-2-ol;2,5-bis(3-aminopropylamino)-N-[3-[4-[[3-[2,5-bis(3-aminopropylamino)pentanoylamino]-2-hydroxypropyl]-[(E)-octadec-9-enyl]amino]butyl-[(Z)-octadec-9-enyl]amino]-2-hydroxypropyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-hydroxypropyl]-[(Z)-octadec-9-enyl]amino]butyl-[(Z)-dodec-9-enyl]amino]-2-hydroxypropyl]guanidine;diiodovanadium;methane;pyrazole-1-carboximidamide;vanadium;hydrochloride
CID 176520748
1-[3-[4-[[3-(diaminomethylideneamino)-2-hydroxypropyl]-[(E)-octadec-9-enyl]amino]butyl-[(E)-octadec-9-enyl]amino]-2-hydroxypropyl]guanidine
CID 176517013
1-[3-[2-[5-[2-[3-carbamimidamidopropyl-[3-(diaminomethylideneamino)propyl]amino]ethyl-[(Z)-non-3-enoxy]phosphoryl]oxypentoxy-[(Z)-non-3-enoxy]phosphoryl]ethyl-[3-(diaminomethylideneamino)propyl]amino]propyl]guanidine;hexahydrochloride
CID 176531973
1-[3-[4-[[3-(diaminomethylideneamino)-2-hydroxypropyl]-octadec-9-enylamino]butyl-dodec-9-enylamino]-2-hydroxypropyl]guanidine
CID 176527536
2-[[(2S)-2,5-bis(3-aminopropylamino)pentanoyl]amino]ethyl-[2,3-bis[(Z)-octadec-9-enoxy]propyl]-dimethylazanium chloride
CID 172946136
2-[2,5-bis(3-aminopropylamino)pentanoylamino]ethyl-[2,3-bis(octadec-9-enoxy)-2,3-dioctadecoxypropyl]-dimethylazanium
CID 57081297
2-[3-(dimethylamino)propylamino]-N-[(Z)-octadec-9-enyl]heptadecanamide;ethane
CID 172594451
N-[(2S)-1-[[(2S)-1-[[(2S)-1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]dodecanamide
CID 176526303

Frequently Asked Questions

What is the IUPAC name of N'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine?
The IUPAC name of N'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine (CID 176521361) is N'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine.
What is the SMILES notation for N'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine?
The canonical SMILES for N'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine is CCCCCCCC/C=C\CCCCCCCCN(CCCNC(=O)C(CCCNCCCN)NCCCN)CCOCCOCCN(CCCCCCCC/C=C\CCCCCCCC)CCCNC(=O)C(CCCNCCCN)NCCCN.CCCCCCCCC=CCCCCCCCCN(CCCN)CCOCCOCCOCCN(CCCN)CCCCCCCCC=CCCCCCCCC.[H]/N=C(\N)NCC(C)CN(CCCCCCCCC=CCCCCCCCC)CCCCN(CCCCCCCCC=CCCCCCCCC)CC(C)CN=C(N)N.[H]/N=C(\N)NCCCN(CCCCCCCCC=CCCCCCCCC)CCCCN(CCCCCCCCC=CCCCCCCCC)CCCN=C(N)N.
What is the InChIKey of N'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine?
The InChIKey is LNHLILBDFBRFIN-SUGRRRODSA-N. The full InChI is InChI=1S/C70H146N12O4.C50H102N8.C50H102N4O3.C48H98N8/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-57-81(59-41-55-79-69(83)67(77-53-39-47-73)43-35-49-75-51-37-45-71)61-63-85-65-66-86-64-62-82(58-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)60-42-56-80-70(84)68(78-54-40-48-74)44-36-50-76-52-38-46-72;1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39-57(45-47(3)43-55-49(51)52)41-37-38-42-58(46-48(4)44-56-50(53)54)40-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39-53(41-35-37-51)43-45-55-47-49-57-50-48-56-46-44-54(42-36-38-52)40-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41-55(45-37-39-53-47(49)50)43-35-36-44-56(46-38-40-54-48(51)52)42-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,67-68,75-78H,3-16,21-66,71-74H2,1-2H3,(H,79,83)(H,80,84);19-22,47-48H,5-18,23-46H2,1-4H3,(H4,51,52,55)(H4,53,54,56);17-20H,3-16,21-52H2,1-2H3;17-20H,3-16,21-46H2,1-2H3,(H4,49,50,53)(H4,51,52,54)/b19-17-,20-18-;;;.
What are the key properties of N'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine?
N'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine has a molecular weight of 3630.20 g/mol, XLogP of 47.63, 213 rotatable bonds, 22 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-[2-[2-[2-[3-aminopropyl(octadec-9-enyl)amino]ethoxy]ethoxy]ethoxy]ethyl]-N'-octadec-9-enylpropane-1,3-diamine;2,5-bis(3-aminopropylamino)-N-[3-[2-[2-[2-[3-[2,5-bis(3-aminopropylamino)pentanoylamino]propyl-[(Z)-octadec-9-enyl]amino]ethoxy]ethoxy]ethyl-[(Z)-octadec-9-enyl]amino]propyl]pentanamide;1-[3-[4-[[3-(diaminomethylideneamino)-2-methylpropyl]-octadec-9-enylamino]butyl-octadec-9-enylamino]-2-methylpropyl]guanidine;1-[3-[4-[3-(diaminomethylideneamino)propyl-octadec-9-enylamino]butyl-octadec-9-enylamino]propyl]guanidine is sourced from PubChem (CID 176521361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).