2-diazonioimino-1-ethylpyridine

C7H9N4+ — CID 11096581

IUPAC2-diazonioimino-1-ethylpyridine
SMILESCCn1ccccc1=N[N+]#N
InChIInChI=1S/C7H9N4/c1-2-11-6-4-3-5-7(11)9-10-8/h3-6H,2H2,1H3/q+1
InChIKeyGVGCZZNSNSFEFE-UHFFFAOYSA-N
MW149.18 g/mol
LogP1.18
Rot. Bonds1

About 2-diazonioimino-1-ethylpyridine

2-diazonioimino-1-ethylpyridine (PubChem CID 11096581) has the molecular formula C7H9N4+ and a molecular weight of 149.18 g/mol. Its IUPAC name is 2-diazonioimino-1-ethylpyridine.

Molecular Properties

Compound Name2-diazonioimino-1-ethylpyridine
PubChem CID11096581
Molecular FormulaC7H9N4+
Molecular Weight149.18 g/mol
Exact Mass149.08
IUPAC Name2-diazonioimino-1-ethylpyridine
SMILESCCn1ccccc1=N[N+]#N
InChIInChI=1S/C7H9N4/c1-2-11-6-4-3-5-7(11)9-10-8/h3-6H,2H2,1H3/q+1
InChIKeyGVGCZZNSNSFEFE-UHFFFAOYSA-N
XLogP1.18
TPSA45.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.18
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Azo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-methylpyridin-2(1H)-imine
CID 138111
1-Prop-2-enylpyridin-2-imine
CID 10866378
1-Ethylpyridin-2(1H)-imine
CID 12924176
(E)-(1-methyl-2-pyridinylidene)hydrazine;hydrochloride
CID 24198911
2(1H)-Pyridinone, 1-methyl-, hydrazone
CID 432408
2-(Azaethylidene)-1-methylhydropyridine
CID 4463569
2-Hydrazono-1-methyl-1,2-dihydropyridine
CID 5477303
(E)-(1-methyl-2-pyridinylidene)hydrazine
CID 6387076
4-Ethylimidazo[1,2-a]pyridin-4-ium
CID 18001023
4H-pyrido[2,1-c][1,2,4]triazine
CID 20362076
(Z)-1-methyl-N-[(Z)-(1-methyl-2-pyridinylidene)amino]pyridin-2-imine
CID 59078018
1-(2H-pyridin-1-yl)ethylidenehydrazine
CID 70446967

Frequently Asked Questions

What is the IUPAC name of 2-diazonioimino-1-ethylpyridine?
The IUPAC name of 2-diazonioimino-1-ethylpyridine (CID 11096581) is 2-diazonioimino-1-ethylpyridine.
What is the SMILES notation for 2-diazonioimino-1-ethylpyridine?
The canonical SMILES for 2-diazonioimino-1-ethylpyridine is CCn1ccccc1=N[N+]#N.
What is the InChIKey of 2-diazonioimino-1-ethylpyridine?
The InChIKey is GVGCZZNSNSFEFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N4/c1-2-11-6-4-3-5-7(11)9-10-8/h3-6H,2H2,1H3/q+1.
What are the key properties of 2-diazonioimino-1-ethylpyridine?
2-diazonioimino-1-ethylpyridine has a molecular weight of 149.18 g/mol, XLogP of 1.18, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diazonioimino-1-ethylpyridine is sourced from PubChem (CID 11096581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).