N-(6-chloro-3-pyridinyl)cyclopropanesulfonamide

C8H9ClN2O2S — CID 103649273

IUPACN-(6-chloro-3-pyridinyl)cyclopropanesulfonamide
SMILESO=S(=O)(Nc1ccc(Cl)nc1)C1CC1
InChIInChI=1S/C8H9ClN2O2S/c9-8-4-1-6(5-10-8)11-14(12,13)7-2-3-7/h1,4-5,7,11H,2-3H2
InChIKeyKSVIUWHLZIOCGT-UHFFFAOYSA-N
MW232.69 g/mol
LogP1.64
Rot. Bonds3

About N-(6-chloro-3-pyridinyl)cyclopropanesulfonamide

N-(6-chloro-3-pyridinyl)cyclopropanesulfonamide (PubChem CID 103649273) has the molecular formula C8H9ClN2O2S and a molecular weight of 232.69 g/mol. Its IUPAC name is N-(6-chloro-3-pyridinyl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(6-chloro-3-pyridinyl)cyclopropanesulfonamide
PubChem CID103649273
Molecular FormulaC8H9ClN2O2S
Molecular Weight232.69 g/mol
Exact Mass232.01
IUPAC NameN-(6-chloro-3-pyridinyl)cyclopropanesulfonamide
SMILESO=S(=O)(Nc1ccc(Cl)nc1)C1CC1
InChIInChI=1S/C8H9ClN2O2S/c9-8-4-1-6(5-10-8)11-14(12,13)7-2-3-7/h1,4-5,7,11H,2-3H2
InChIKeyKSVIUWHLZIOCGT-UHFFFAOYSA-N
XLogP1.64
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.69
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-3-pyridinyl)cyclopropanesulfonamide?
The IUPAC name of N-(6-chloro-3-pyridinyl)cyclopropanesulfonamide (CID 103649273) is N-(6-chloro-3-pyridinyl)cyclopropanesulfonamide.
What is the SMILES notation for N-(6-chloro-3-pyridinyl)cyclopropanesulfonamide?
The canonical SMILES for N-(6-chloro-3-pyridinyl)cyclopropanesulfonamide is O=S(=O)(Nc1ccc(Cl)nc1)C1CC1.
What is the InChIKey of N-(6-chloro-3-pyridinyl)cyclopropanesulfonamide?
The InChIKey is KSVIUWHLZIOCGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN2O2S/c9-8-4-1-6(5-10-8)11-14(12,13)7-2-3-7/h1,4-5,7,11H,2-3H2.
What are the key properties of N-(6-chloro-3-pyridinyl)cyclopropanesulfonamide?
N-(6-chloro-3-pyridinyl)cyclopropanesulfonamide has a molecular weight of 232.69 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-3-pyridinyl)cyclopropanesulfonamide is sourced from PubChem (CID 103649273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).