bis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide

C8H26DyN6S4Sb — CID 139196463

IUPACbis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide
SMILESNCCNCCN.NCCNCCN.[Dy+3].[S-2].[S-2].[S-2].[S-2].[Sb+5]
InChIInChI=1S/2C4H13N3.Dy.4S.Sb/c2*5-1-3-7-4-2-6;;;;;;/h2*7H,1-6H2;;;;;;/q;;+3;4*-2;+5
InChIKeyHNRZBZYTSAJBRI-UHFFFAOYSA-N
MW618.87 g/mol
LogP-3.40
Rot. Bonds8

About bis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide

bis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide (PubChem CID 139196463) has the molecular formula C8H26DyN6S4Sb and a molecular weight of 618.87 g/mol. Its IUPAC name is bis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide.

Molecular Properties

Compound Namebis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide
PubChem CID139196463
Molecular FormulaC8H26DyN6S4Sb
Molecular Weight618.87 g/mol
Exact Mass618.94
IUPAC Namebis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide
SMILESNCCNCCN.NCCNCCN.[Dy+3].[S-2].[S-2].[S-2].[S-2].[Sb+5]
InChIInChI=1S/2C4H13N3.Dy.4S.Sb/c2*5-1-3-7-4-2-6;;;;;;/h2*7H,1-6H2;;;;;;/q;;+3;4*-2;+5
InChIKeyHNRZBZYTSAJBRI-UHFFFAOYSA-N
XLogP-3.40
TPSA128.14 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500618.87
LogP ≤ 5-3.40
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]ethyl]ethane-1,2-diamine;N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine;N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;N'-(2-aminoethyl)ethane-1,2-diamine
CID 159410169
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine
CID 5565
N'-[2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]ethyl]ethane-1,2-diamine;pentahydrochloride
CID 10150970
N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine;antimony(5+);ethane-1,2-diamine;lanthanum(3+);tetrakis(selenium(2-))
CID 139165833
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene
CID 159799374
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;N'-[2-(3-aminopropylamino)ethyl]propane-1,3-diamine
CID 23206687
N'-(2-aminoethyl)-N-(3-aminopropyl)butane-1,4-diamine
CID 118361903
N'-(2-fluoroethyl)ethane-1,2-diamine
CID 80696987
N'-(2-bromoethyl)ethane-1,2-diamine
CID 11788500
dodecasodium;N'-(2-aminoethyl)ethane-1,2-diamine;tetraborate
CID 159570968
N'-[2-[2-(fluoroamino)ethylamino]ethyl]ethane-1,2-diamine
CID 87318857
N'-(2-aminoethyl)propane-1,3-diamine;N'-(6-aminohexyl)hexane-1,6-diamine
CID 126572860

Frequently Asked Questions

What is the IUPAC name of bis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide?
The IUPAC name of bis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide (CID 139196463) is bis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide.
What is the SMILES notation for bis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide?
The canonical SMILES for bis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide is NCCNCCN.NCCNCCN.[Dy+3].[S-2].[S-2].[S-2].[S-2].[Sb+5].
What is the InChIKey of bis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide?
The InChIKey is HNRZBZYTSAJBRI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H13N3.Dy.4S.Sb/c2*5-1-3-7-4-2-6;;;;;;/h2*7H,1-6H2;;;;;;/q;;+3;4*-2;+5.
What are the key properties of bis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide?
bis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide has a molecular weight of 618.87 g/mol, XLogP of -3.40, 8 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide is sourced from PubChem (CID 139196463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).