sodium (diethylhydrazinylidene)-dioxidoazanium

C4H10N3NaO2 — CID 22022822

IUPACsodium (diethylhydrazinylidene)-dioxidoazanium
SMILESCCN(CC)N=[N+]([O-])[O-].[Na+]
InChIInChI=1S/C4H10N3O2.Na/c1-3-6(4-2)5-7(8)9;/h3-4H2,1-2H3;/q-1;+1
InChIKeyNMXCZJUIMOPLNS-UHFFFAOYSA-N
MW155.13 g/mol
LogP-2.29
Rot. Bonds3

About sodium (diethylhydrazinylidene)-dioxidoazanium

sodium (diethylhydrazinylidene)-dioxidoazanium (PubChem CID 22022822) has the molecular formula C4H10N3NaO2 and a molecular weight of 155.13 g/mol. Its IUPAC name is sodium (diethylhydrazinylidene)-dioxidoazanium.

Molecular Properties

Compound Namesodium (diethylhydrazinylidene)-dioxidoazanium
PubChem CID22022822
Molecular FormulaC4H10N3NaO2
Molecular Weight155.13 g/mol
Exact Mass155.07
IUPAC Namesodium (diethylhydrazinylidene)-dioxidoazanium
SMILESCCN(CC)N=[N+]([O-])[O-].[Na+]
InChIInChI=1S/C4H10N3O2.Na/c1-3-6(4-2)5-7(8)9;/h3-4H2,1-2H3;/q-1;+1
InChIKeyNMXCZJUIMOPLNS-UHFFFAOYSA-N
XLogP-2.29
TPSA64.73 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.13
LogP ≤ 5-2.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

sodium N-diazenyl-N-ethylethanamine
CID 172778091
sodium;[ethyl(propan-2-yl)amino]-hydroxyimino-oxidoazanium;hydride
CID 173036497
N-ethyl-N-(1,1,2,2-tetradeuterioethyl)nitrous amide
CID 126456058
N-azido-N-ethylethanamine
CID 15140924
[tert-butyl(ethyl)amino]-hydroxyimino-oxidoazanium
CID 172706340
(Z)-diethylcarbamoylimino-methyl-oxidoazanium
CID 177428023
N-ethyl-N-methanidylethanamine;rhenium
CID 59858121
N,N-diethyl-1-nitroethanamine
CID 22278012
CID 136618121
CID 136618121
2-(diethylhydrazinylidene)propanedioic acid
CID 123769304
N-[2-(dimethylamino)ethyl]-N-ethylnitrous amide
CID 156620436
sodium (Z)-methyl-oxido-oxidoiminoazanium
CID 172966410

Frequently Asked Questions

What is the IUPAC name of sodium (diethylhydrazinylidene)-dioxidoazanium?
The IUPAC name of sodium (diethylhydrazinylidene)-dioxidoazanium (CID 22022822) is sodium (diethylhydrazinylidene)-dioxidoazanium.
What is the SMILES notation for sodium (diethylhydrazinylidene)-dioxidoazanium?
The canonical SMILES for sodium (diethylhydrazinylidene)-dioxidoazanium is CCN(CC)N=[N+]([O-])[O-].[Na+].
What is the InChIKey of sodium (diethylhydrazinylidene)-dioxidoazanium?
The InChIKey is NMXCZJUIMOPLNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N3O2.Na/c1-3-6(4-2)5-7(8)9;/h3-4H2,1-2H3;/q-1;+1.
What are the key properties of sodium (diethylhydrazinylidene)-dioxidoazanium?
sodium (diethylhydrazinylidene)-dioxidoazanium has a molecular weight of 155.13 g/mol, XLogP of -2.29, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium (diethylhydrazinylidene)-dioxidoazanium is sourced from PubChem (CID 22022822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).