5-cyclopropylpentane-1-sulfonamide

C8H17NO2S — CID 67223678

IUPAC5-cyclopropylpentane-1-sulfonamide
SMILESNS(=O)(=O)CCCCCC1CC1
InChIInChI=1S/C8H17NO2S/c9-12(10,11)7-3-1-2-4-8-5-6-8/h8H,1-7H2,(H2,9,10,11)
InChIKeySSFWUOHSWAJKLA-UHFFFAOYSA-N
MW191.30 g/mol
LogP1.25
Rot. Bonds6

About 5-cyclopropylpentane-1-sulfonamide

5-cyclopropylpentane-1-sulfonamide (PubChem CID 67223678) has the molecular formula C8H17NO2S and a molecular weight of 191.30 g/mol. Its IUPAC name is 5-cyclopropylpentane-1-sulfonamide.

Molecular Properties

Compound Name5-cyclopropylpentane-1-sulfonamide
PubChem CID67223678
Molecular FormulaC8H17NO2S
Molecular Weight191.30 g/mol
Exact Mass191.10
IUPAC Name5-cyclopropylpentane-1-sulfonamide
SMILESNS(=O)(=O)CCCCCC1CC1
InChIInChI=1S/C8H17NO2S/c9-12(10,11)7-3-1-2-4-8-5-6-8/h8H,1-7H2,(H2,9,10,11)
InChIKeySSFWUOHSWAJKLA-UHFFFAOYSA-N
XLogP1.25
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.30
LogP ≤ 51.25
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 5-cyclopropylpentane-1-sulfonamide?
The IUPAC name of 5-cyclopropylpentane-1-sulfonamide (CID 67223678) is 5-cyclopropylpentane-1-sulfonamide.
What is the SMILES notation for 5-cyclopropylpentane-1-sulfonamide?
The canonical SMILES for 5-cyclopropylpentane-1-sulfonamide is NS(=O)(=O)CCCCCC1CC1.
What is the InChIKey of 5-cyclopropylpentane-1-sulfonamide?
The InChIKey is SSFWUOHSWAJKLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2S/c9-12(10,11)7-3-1-2-4-8-5-6-8/h8H,1-7H2,(H2,9,10,11).
What are the key properties of 5-cyclopropylpentane-1-sulfonamide?
5-cyclopropylpentane-1-sulfonamide has a molecular weight of 191.30 g/mol, XLogP of 1.25, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropylpentane-1-sulfonamide is sourced from PubChem (CID 67223678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).