1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide

C9H10F2N2O2S — CID 103098073

IUPAC1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide
SMILESO=S(=O)(CC1CC1)Nc1ccc(F)nc1F
InChIInChI=1S/C9H10F2N2O2S/c10-8-4-3-7(9(11)12-8)13-16(14,15)5-6-1-2-6/h3-4,6,13H,1-2,5H2
InChIKeySDFSBDMVSICMCZ-UHFFFAOYSA-N
MW248.25 g/mol
LogP1.51
Rot. Bonds4

About 1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide

1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide (PubChem CID 103098073) has the molecular formula C9H10F2N2O2S and a molecular weight of 248.25 g/mol. Its IUPAC name is 1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide.

Molecular Properties

Compound Name1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide
PubChem CID103098073
Molecular FormulaC9H10F2N2O2S
Molecular Weight248.25 g/mol
Exact Mass248.04
IUPAC Name1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide
SMILESO=S(=O)(CC1CC1)Nc1ccc(F)nc1F
InChIInChI=1S/C9H10F2N2O2S/c10-8-4-3-7(9(11)12-8)13-16(14,15)5-6-1-2-6/h3-4,6,13H,1-2,5H2
InChIKeySDFSBDMVSICMCZ-UHFFFAOYSA-N
XLogP1.51
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.25
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(6-Fluoropyridin-3-yl)ethanesulfonamide
CID 104922560
N-(5-fluoro-3-pyridinyl)propane-1-sulfonamide
CID 110872349
N-[2-methyl-6-(1,1,2-trifluoroethyl)-3-pyridinyl]-4-propan-2-ylcyclohepta-2,4,6-triene-1-sulfonamide
CID 123256921
N-(6-fluoro-2-iodo-3-pyridinyl)benzenesulfonamide
CID 156412999
6-Fluoro-2-(2-methylsulfonylethyl)pyridin-3-amine
CID 174719884
(6-Fluoro-2-pyridinyl)methanesulfonamide
CID 175997304
N-(5-fluoro-3-pyridinyl)cyclopropanesulfonamide
CID 176066751
N-(3-amino-6-fluoro-2-pyridinyl)ethanesulfonamide
CID 176276426
4,4,4-trifluoro-N-pyridin-3-ylbutane-1-sulfonamide
CID 71905485
N-(2,6-difluoro-3-pyridinyl)-2-methylsulfonylacetamide
CID 103097646
N-(2,6-difluoro-3-pyridinyl)-1,1-dioxothiolane-3-carboxamide
CID 103097651
N-(2,6-difluoro-3-pyridinyl)-2-methylsulfonylpropanamide
CID 103097780

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide?
The IUPAC name of 1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide (CID 103098073) is 1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide.
What is the SMILES notation for 1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide?
The canonical SMILES for 1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide is O=S(=O)(CC1CC1)Nc1ccc(F)nc1F.
What is the InChIKey of 1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide?
The InChIKey is SDFSBDMVSICMCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F2N2O2S/c10-8-4-3-7(9(11)12-8)13-16(14,15)5-6-1-2-6/h3-4,6,13H,1-2,5H2.
What are the key properties of 1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide?
1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide has a molecular weight of 248.25 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(2,6-difluoro-3-pyridinyl)methanesulfonamide is sourced from PubChem (CID 103098073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).