N',N'-bis[2-(aminodiazenyl)ethyl]ethane-1,2-diamine

C6H18N8 — CID 118629316

IUPACN',N'-bis[2-(aminodiazenyl)ethyl]ethane-1,2-diamine
SMILESNCCN(CC/N=N/N)CC/N=N/N
InChIInChI=1S/C6H18N8/c7-1-4-14(5-2-10-12-8)6-3-11-13-9/h1-7H2,(H2,8,10)(H2,9,11)
InChIKeyKOURFMSHDOOVGM-UHFFFAOYSA-N
MW202.27 g/mol
LogP-1.10
Rot. Bonds8

About N',N'-bis[2-(aminodiazenyl)ethyl]ethane-1,2-diamine

N',N'-bis[2-(aminodiazenyl)ethyl]ethane-1,2-diamine (PubChem CID 118629316) has the molecular formula C6H18N8 and a molecular weight of 202.27 g/mol. Its IUPAC name is N',N'-bis[2-(aminodiazenyl)ethyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-bis[2-(aminodiazenyl)ethyl]ethane-1,2-diamine
PubChem CID118629316
Molecular FormulaC6H18N8
Molecular Weight202.27 g/mol
Exact Mass202.17
IUPAC NameN',N'-bis[2-(aminodiazenyl)ethyl]ethane-1,2-diamine
SMILESNCCN(CC/N=N/N)CC/N=N/N
InChIInChI=1S/C6H18N8/c7-1-4-14(5-2-10-12-8)6-3-11-13-9/h1-7H2,(H2,8,10)(H2,9,11)
InChIKeyKOURFMSHDOOVGM-UHFFFAOYSA-N
XLogP-1.10
TPSA130.74 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.27
LogP ≤ 5-1.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N',N'-bis[2-(aminodiazenyl)ethyl]ethane-1,2-diamine?
The IUPAC name of N',N'-bis[2-(aminodiazenyl)ethyl]ethane-1,2-diamine (CID 118629316) is N',N'-bis[2-(aminodiazenyl)ethyl]ethane-1,2-diamine.
What is the SMILES notation for N',N'-bis[2-(aminodiazenyl)ethyl]ethane-1,2-diamine?
The canonical SMILES for N',N'-bis[2-(aminodiazenyl)ethyl]ethane-1,2-diamine is NCCN(CC/N=N/N)CC/N=N/N.
What is the InChIKey of N',N'-bis[2-(aminodiazenyl)ethyl]ethane-1,2-diamine?
The InChIKey is KOURFMSHDOOVGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H18N8/c7-1-4-14(5-2-10-12-8)6-3-11-13-9/h1-7H2,(H2,8,10)(H2,9,11).
What are the key properties of N',N'-bis[2-(aminodiazenyl)ethyl]ethane-1,2-diamine?
N',N'-bis[2-(aminodiazenyl)ethyl]ethane-1,2-diamine has a molecular weight of 202.27 g/mol, XLogP of -1.10, 8 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-bis[2-(aminodiazenyl)ethyl]ethane-1,2-diamine is sourced from PubChem (CID 118629316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).