2-(2-hydrazinylethyldisulfanyl)ethanamine

C4H13N3S2 — CID 54043672

IUPAC2-(2-hydrazinylethyldisulfanyl)ethanamine
SMILESNCCSSCCNN
InChIInChI=1S/C4H13N3S2/c5-1-3-8-9-4-2-7-6/h7H,1-6H2
InChIKeyLOBSVEBSBQPERF-UHFFFAOYSA-N
MW167.30 g/mol
LogP-0.21
Rot. Bonds6

About 2-(2-hydrazinylethyldisulfanyl)ethanamine

2-(2-hydrazinylethyldisulfanyl)ethanamine (PubChem CID 54043672) has the molecular formula C4H13N3S2 and a molecular weight of 167.30 g/mol. Its IUPAC name is 2-(2-hydrazinylethyldisulfanyl)ethanamine.

Molecular Properties

Compound Name2-(2-hydrazinylethyldisulfanyl)ethanamine
PubChem CID54043672
Molecular FormulaC4H13N3S2
Molecular Weight167.30 g/mol
Exact Mass167.06
IUPAC Name2-(2-hydrazinylethyldisulfanyl)ethanamine
SMILESNCCSSCCNN
InChIInChI=1S/C4H13N3S2/c5-1-3-8-9-4-2-7-6/h7H,1-6H2
InChIKeyLOBSVEBSBQPERF-UHFFFAOYSA-N
XLogP-0.21
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 5-0.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-Hydrazinylethanethiol
CID 12457063
2-[2-(Diaminoamino)ethyldisulfanyl]ethanamine
CID 90939967
3-Hydrazinylpropane-1-thiol
CID 54156855
2-(2-Ethylhydrazinyl)ethanethial
CID 88002650
2-(2-hydrazinylethyldisulfanyl)-N-methylethanamine
CID 88966067
1-Ethyl-2-(2-methylsulfanylethyl)hydrazine
CID 89111940
2-(2-Ethylhydrazinyl)ethanethiol
CID 89211261
2-Ethyl-1-ethylsulfanyl-1-methylhydrazine
CID 123571583
1-Hydrazinylethane-1,2-dithiol
CID 123824831
2-[2-[2-(Methyldisulfanyl)ethyl]hydrazinyl]ethanethiol
CID 126655685
1-Hydrazinylbutane-1,3-dithiol
CID 141493023
2-[2-[2-(2-Aminoethyldisulfanyl)ethyl]hydrazinyl]ethanethiol
CID 145185731

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydrazinylethyldisulfanyl)ethanamine?
The IUPAC name of 2-(2-hydrazinylethyldisulfanyl)ethanamine (CID 54043672) is 2-(2-hydrazinylethyldisulfanyl)ethanamine.
What is the SMILES notation for 2-(2-hydrazinylethyldisulfanyl)ethanamine?
The canonical SMILES for 2-(2-hydrazinylethyldisulfanyl)ethanamine is NCCSSCCNN.
What is the InChIKey of 2-(2-hydrazinylethyldisulfanyl)ethanamine?
The InChIKey is LOBSVEBSBQPERF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H13N3S2/c5-1-3-8-9-4-2-7-6/h7H,1-6H2.
What are the key properties of 2-(2-hydrazinylethyldisulfanyl)ethanamine?
2-(2-hydrazinylethyldisulfanyl)ethanamine has a molecular weight of 167.30 g/mol, XLogP of -0.21, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydrazinylethyldisulfanyl)ethanamine is sourced from PubChem (CID 54043672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).