nonane-1-sulfonamide

C9H21NO2S — CID 22761547

IUPACnonane-1-sulfonamide
SMILESCCCCCCCCCS(N)(=O)=O
InChIInChI=1S/C9H21NO2S/c1-2-3-4-5-6-7-8-9-13(10,11)12/h2-9H2,1H3,(H2,10,11,12)
InChIKeyNLWIMJPEFDUCJU-UHFFFAOYSA-N
MW207.34 g/mol
LogP2.03
Rot. Bonds8

About nonane-1-sulfonamide

nonane-1-sulfonamide (PubChem CID 22761547) has the molecular formula C9H21NO2S and a molecular weight of 207.34 g/mol. Its IUPAC name is nonane-1-sulfonamide.

Molecular Properties

Compound Namenonane-1-sulfonamide
PubChem CID22761547
Molecular FormulaC9H21NO2S
Molecular Weight207.34 g/mol
Exact Mass207.13
IUPAC Namenonane-1-sulfonamide
SMILESCCCCCCCCCS(N)(=O)=O
InChIInChI=1S/C9H21NO2S/c1-2-3-4-5-6-7-8-9-13(10,11)12/h2-9H2,1H3,(H2,10,11,12)
InChIKeyNLWIMJPEFDUCJU-UHFFFAOYSA-N
XLogP2.03
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.34
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of nonane-1-sulfonamide?
The IUPAC name of nonane-1-sulfonamide (CID 22761547) is nonane-1-sulfonamide.
What is the SMILES notation for nonane-1-sulfonamide?
The canonical SMILES for nonane-1-sulfonamide is CCCCCCCCCS(N)(=O)=O.
What is the InChIKey of nonane-1-sulfonamide?
The InChIKey is NLWIMJPEFDUCJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO2S/c1-2-3-4-5-6-7-8-9-13(10,11)12/h2-9H2,1H3,(H2,10,11,12).
What are the key properties of nonane-1-sulfonamide?
nonane-1-sulfonamide has a molecular weight of 207.34 g/mol, XLogP of 2.03, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for nonane-1-sulfonamide is sourced from PubChem (CID 22761547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).