cyclopenta-1,3-diene-1-sulfonamide

C5H7NO2S — CID 12936333

IUPACcyclopenta-1,3-diene-1-sulfonamide
SMILESNS(=O)(=O)C1=CC=CC1
InChIInChI=1S/C5H7NO2S/c6-9(7,8)5-3-1-2-4-5/h1-3H,4H2,(H2,6,7,8)
InChIKeyAUOQYGLGQYMIKA-UHFFFAOYSA-N
MW145.18 g/mol
LogP0.12
Rot. Bonds1

About cyclopenta-1,3-diene-1-sulfonamide

cyclopenta-1,3-diene-1-sulfonamide (PubChem CID 12936333) has the molecular formula C5H7NO2S and a molecular weight of 145.18 g/mol. Its IUPAC name is cyclopenta-1,3-diene-1-sulfonamide.

Molecular Properties

Compound Namecyclopenta-1,3-diene-1-sulfonamide
PubChem CID12936333
Molecular FormulaC5H7NO2S
Molecular Weight145.18 g/mol
Exact Mass145.02
IUPAC Namecyclopenta-1,3-diene-1-sulfonamide
SMILESNS(=O)(=O)C1=CC=CC1
InChIInChI=1S/C5H7NO2S/c6-9(7,8)5-3-1-2-4-5/h1-3H,4H2,(H2,6,7,8)
InChIKeyAUOQYGLGQYMIKA-UHFFFAOYSA-N
XLogP0.12
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.18
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopenta-1,3-diene-1-sulfonamide?
The IUPAC name of cyclopenta-1,3-diene-1-sulfonamide (CID 12936333) is cyclopenta-1,3-diene-1-sulfonamide.
What is the SMILES notation for cyclopenta-1,3-diene-1-sulfonamide?
The canonical SMILES for cyclopenta-1,3-diene-1-sulfonamide is NS(=O)(=O)C1=CC=CC1.
What is the InChIKey of cyclopenta-1,3-diene-1-sulfonamide?
The InChIKey is AUOQYGLGQYMIKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NO2S/c6-9(7,8)5-3-1-2-4-5/h1-3H,4H2,(H2,6,7,8).
What are the key properties of cyclopenta-1,3-diene-1-sulfonamide?
cyclopenta-1,3-diene-1-sulfonamide has a molecular weight of 145.18 g/mol, XLogP of 0.12, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-1,3-diene-1-sulfonamide is sourced from PubChem (CID 12936333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).