N-diazononane-1-sulfonamide

C9H19N3O2S — CID 21453350

IUPACN-diazononane-1-sulfonamide
SMILESCCCCCCCCCS(=O)(=O)N=[N+]=[N-]
InChIInChI=1S/C9H19N3O2S/c1-2-3-4-5-6-7-8-9-15(13,14)12-11-10/h2-9H2,1H3
InChIKeyAUNIATBDKPXANE-UHFFFAOYSA-N
MW233.34 g/mol
LogP3.38
Rot. Bonds9

About N-diazononane-1-sulfonamide

N-diazononane-1-sulfonamide (PubChem CID 21453350) has the molecular formula C9H19N3O2S and a molecular weight of 233.34 g/mol. Its IUPAC name is N-diazononane-1-sulfonamide.

Molecular Properties

Compound NameN-diazononane-1-sulfonamide
PubChem CID21453350
Molecular FormulaC9H19N3O2S
Molecular Weight233.34 g/mol
Exact Mass233.12
IUPAC NameN-diazononane-1-sulfonamide
SMILESCCCCCCCCCS(=O)(=O)N=[N+]=[N-]
InChIInChI=1S/C9H19N3O2S/c1-2-3-4-5-6-7-8-9-15(13,14)12-11-10/h2-9H2,1H3
InChIKeyAUNIATBDKPXANE-UHFFFAOYSA-N
XLogP3.38
TPSA82.90 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

hexylsilane;sulfuryl diazide
CID 173397823
2-azidoethyl decane-1-sulfonate
CID 44625994
1-octylsulfonylnonane
CID 19089492
1-ethylsulfonylheptane
CID 19089519
N-diazo-2-triethoxysilylhexane-1-sulfonamide
CID 19882891
trihexyl(methyl)-λ4-sulfane
CID 138739733
N-diazo-5-(2,5-dioxopyrrol-3-yl)pentane-1-sulfonamide
CID 88712729
1-methylsulfonylnonane
CID 19089493
1-(nonylsulfonylmethylsulfonyl)nonane
CID 139912693
1-(octylsulfonylmethylsulfonyl)octane
CID 3455822
pentacosane-1-sulfonamide
CID 149252389
1-azidotriacontane
CID 71752669

Frequently Asked Questions

What is the IUPAC name of N-diazononane-1-sulfonamide?
The IUPAC name of N-diazononane-1-sulfonamide (CID 21453350) is N-diazononane-1-sulfonamide.
What is the SMILES notation for N-diazononane-1-sulfonamide?
The canonical SMILES for N-diazononane-1-sulfonamide is CCCCCCCCCS(=O)(=O)N=[N+]=[N-].
What is the InChIKey of N-diazononane-1-sulfonamide?
The InChIKey is AUNIATBDKPXANE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2S/c1-2-3-4-5-6-7-8-9-15(13,14)12-11-10/h2-9H2,1H3.
What are the key properties of N-diazononane-1-sulfonamide?
N-diazononane-1-sulfonamide has a molecular weight of 233.34 g/mol, XLogP of 3.38, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-diazononane-1-sulfonamide is sourced from PubChem (CID 21453350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).