N-hydroxycyclopropanesulfonamide

C3H7NO3S — CID 174466142

IUPACN-hydroxycyclopropanesulfonamide
SMILESO=S(=O)(NO)C1CC1
InChIInChI=1S/C3H7NO3S/c5-4-8(6,7)3-1-2-3/h3-5H,1-2H2
InChIKeyWZQWRRBSGLTDOJ-UHFFFAOYSA-N
MW137.16 g/mol
LogP-0.54
Rot. Bonds2

About N-hydroxycyclopropanesulfonamide

N-hydroxycyclopropanesulfonamide (PubChem CID 174466142) has the molecular formula C3H7NO3S and a molecular weight of 137.16 g/mol. Its IUPAC name is N-hydroxycyclopropanesulfonamide.

Molecular Properties

Compound NameN-hydroxycyclopropanesulfonamide
PubChem CID174466142
Molecular FormulaC3H7NO3S
Molecular Weight137.16 g/mol
Exact Mass137.01
IUPAC NameN-hydroxycyclopropanesulfonamide
SMILESO=S(=O)(NO)C1CC1
InChIInChI=1S/C3H7NO3S/c5-4-8(6,7)3-1-2-3/h3-5H,1-2H2
InChIKeyWZQWRRBSGLTDOJ-UHFFFAOYSA-N
XLogP-0.54
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.16
LogP ≤ 5-0.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-hydroxycyclopropanesulfonamide?
The IUPAC name of N-hydroxycyclopropanesulfonamide (CID 174466142) is N-hydroxycyclopropanesulfonamide.
What is the SMILES notation for N-hydroxycyclopropanesulfonamide?
The canonical SMILES for N-hydroxycyclopropanesulfonamide is O=S(=O)(NO)C1CC1.
What is the InChIKey of N-hydroxycyclopropanesulfonamide?
The InChIKey is WZQWRRBSGLTDOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO3S/c5-4-8(6,7)3-1-2-3/h3-5H,1-2H2.
What are the key properties of N-hydroxycyclopropanesulfonamide?
N-hydroxycyclopropanesulfonamide has a molecular weight of 137.16 g/mol, XLogP of -0.54, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxycyclopropanesulfonamide is sourced from PubChem (CID 174466142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).