N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene

C10H26N4 — CID 159799374

IUPACN'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene
SMILESC=C.C=C.NCCNCCNCCN
InChIInChI=1S/C6H18N4.2C2H4/c7-1-3-9-5-6-10-4-2-8;2*1-2/h9-10H,1-8H2;2*1-2H2
InChIKeyNJOZCUNTTTYXOK-UHFFFAOYSA-N
MW202.35 g/mol
LogP-0.31
Rot. Bonds7

About N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene

N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene (PubChem CID 159799374) has the molecular formula C10H26N4 and a molecular weight of 202.35 g/mol. Its IUPAC name is N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene.

Molecular Properties

Compound NameN'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene
PubChem CID159799374
Molecular FormulaC10H26N4
Molecular Weight202.35 g/mol
Exact Mass202.22
IUPAC NameN'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene
SMILESC=C.C=C.NCCNCCNCCN
InChIInChI=1S/C6H18N4.2C2H4/c7-1-3-9-5-6-10-4-2-8;2*1-2/h9-10H,1-8H2;2*1-2H2
InChIKeyNJOZCUNTTTYXOK-UHFFFAOYSA-N
XLogP-0.31
TPSA76.10 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.35
LogP ≤ 5-0.31
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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-aminoethylamino)ethyl]ethane-1,2-diamine;N'-[2-(3-aminopropylamino)ethyl]propane-1,3-diamine
CID 23206687
N'-[2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]ethyl]ethane-1,2-diamine;2-methylprop-1-ene
CID 88832699
N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine;antimony(5+);ethane-1,2-diamine;lanthanum(3+);tetrakis(selenium(2-))
CID 139165833
bis(N'-(2-aminoethyl)ethane-1,2-diamine);antimony(5+);dysprosium(3+);tetrasulfide
CID 139196463
formaldehyde;N'-[2-(propylamino)ethyl]ethane-1,2-diamine
CID 174938120
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;methylphosphonic acid
CID 162177359
N'-[2-(prop-2-enylamino)ethyl]ethane-1,2-diamine
CID 15001042
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;1,2,3,4,5,6-hexachlorocyclohexane
CID 87854799
N'-[2-[2-(fluoroamino)ethylamino]ethyl]ethane-1,2-diamine
CID 87318857

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene?
The IUPAC name of N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene (CID 159799374) is N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene.
What is the SMILES notation for N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene?
The canonical SMILES for N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene is C=C.C=C.NCCNCCNCCN.
What is the InChIKey of N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene?
The InChIKey is NJOZCUNTTTYXOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H18N4.2C2H4/c7-1-3-9-5-6-10-4-2-8;2*1-2/h9-10H,1-8H2;2*1-2H2.
What are the key properties of N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene?
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene has a molecular weight of 202.35 g/mol, XLogP of -0.31, 7 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;ethene is sourced from PubChem (CID 159799374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).