decane-1-sulfonamide

C10H23NO2S — CID 5070648

IUPACdecane-1-sulfonamide
SMILESCCCCCCCCCCS(N)(=O)=O
InChIInChI=1S/C10H23NO2S/c1-2-3-4-5-6-7-8-9-10-14(11,12)13/h2-10H2,1H3,(H2,11,12,13)
InChIKeyLPZONNUBKVPBPL-UHFFFAOYSA-N
MW221.37 g/mol
LogP2.42
Rot. Bonds9

About decane-1-sulfonamide

decane-1-sulfonamide (PubChem CID 5070648) has the molecular formula C10H23NO2S and a molecular weight of 221.37 g/mol. Its IUPAC name is decane-1-sulfonamide.

Molecular Properties

Compound Namedecane-1-sulfonamide
PubChem CID5070648
Molecular FormulaC10H23NO2S
Molecular Weight221.37 g/mol
Exact Mass221.14
IUPAC Namedecane-1-sulfonamide
SMILESCCCCCCCCCCS(N)(=O)=O
InChIInChI=1S/C10H23NO2S/c1-2-3-4-5-6-7-8-9-10-14(11,12)13/h2-10H2,1H3,(H2,11,12,13)
InChIKeyLPZONNUBKVPBPL-UHFFFAOYSA-N
XLogP2.42
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.37
LogP ≤ 52.42
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 decane-1-sulfonamide?
The IUPAC name of decane-1-sulfonamide (CID 5070648) is decane-1-sulfonamide.
What is the SMILES notation for decane-1-sulfonamide?
The canonical SMILES for decane-1-sulfonamide is CCCCCCCCCCS(N)(=O)=O.
What is the InChIKey of decane-1-sulfonamide?
The InChIKey is LPZONNUBKVPBPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2S/c1-2-3-4-5-6-7-8-9-10-14(11,12)13/h2-10H2,1H3,(H2,11,12,13).
What are the key properties of decane-1-sulfonamide?
decane-1-sulfonamide has a molecular weight of 221.37 g/mol, XLogP of 2.42, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for decane-1-sulfonamide is sourced from PubChem (CID 5070648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).