N-(2-bromocyclopentyl)-3-fluoropyridine-2-sulfonamide

C10H12BrFN2O2S — CID 103302197

IUPACN-(2-bromocyclopentyl)-3-fluoropyridine-2-sulfonamide
SMILESO=S(=O)(NC1CCCC1Br)c1ncccc1F
InChIInChI=1S/C10H12BrFN2O2S/c11-7-3-1-5-9(7)14-17(15,16)10-8(12)4-2-6-13-10/h2,4,6-7,9,14H,1,3,5H2
InChIKeyOXVRCILVASJXBJ-UHFFFAOYSA-N
MW323.19 g/mol
LogP1.82
Rot. Bonds3

About N-(2-bromocyclopentyl)-3-fluoropyridine-2-sulfonamide

N-(2-bromocyclopentyl)-3-fluoropyridine-2-sulfonamide (PubChem CID 103302197) has the molecular formula C10H12BrFN2O2S and a molecular weight of 323.19 g/mol. Its IUPAC name is N-(2-bromocyclopentyl)-3-fluoropyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(2-bromocyclopentyl)-3-fluoropyridine-2-sulfonamide
PubChem CID103302197
Molecular FormulaC10H12BrFN2O2S
Molecular Weight323.19 g/mol
Exact Mass321.98
IUPAC NameN-(2-bromocyclopentyl)-3-fluoropyridine-2-sulfonamide
SMILESO=S(=O)(NC1CCCC1Br)c1ncccc1F
InChIInChI=1S/C10H12BrFN2O2S/c11-7-3-1-5-9(7)14-17(15,16)10-8(12)4-2-6-13-10/h2,4,6-7,9,14H,1,3,5H2
InChIKeyOXVRCILVASJXBJ-UHFFFAOYSA-N
XLogP1.82
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.19
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

N-[2-(chloromethyl)cyclopentyl]-3-fluoropyridine-2-sulfonamide
CID 114179771
3-fluoro-N-[2-(hydroxymethyl)cyclohexyl]pyridine-2-sulfonamide
CID 106360576
3-fluoro-N-(2-methylcyclopropyl)pyridine-2-sulfonamide
CID 103300003
N-(2-bromocyclopentyl)-2-fluorobenzenesulfonamide
CID 80662243
3-fluoro-N-(4-hydroxycyclohexyl)pyridine-2-sulfonamide
CID 103299013
3-fluoro-N-(oxan-3-yl)pyridine-2-sulfonamide
CID 103300080
N-(2-bromocyclopentyl)benzenesulfonamide
CID 18999501
N-(2,2-dimethyloxan-4-yl)-3-fluoropyridine-2-sulfonamide
CID 103300360
N-(2-bromocyclohexyl)-3-fluoro-2-nitrobenzenesulfonamide
CID 106441024
N-(2-bromocyclopentyl)-2-pyridin-2-ylethanesulfonamide
CID 80662740
3-fluoro-N',N'-dimethylpyridine-2-sulfonohydrazide
CID 103300356
N-(3-ethoxycyclobutyl)-3-fluoropyridine-2-sulfonamide
CID 114118992

Frequently Asked Questions

What is the IUPAC name of N-(2-bromocyclopentyl)-3-fluoropyridine-2-sulfonamide?
The IUPAC name of N-(2-bromocyclopentyl)-3-fluoropyridine-2-sulfonamide (CID 103302197) is N-(2-bromocyclopentyl)-3-fluoropyridine-2-sulfonamide.
What is the SMILES notation for N-(2-bromocyclopentyl)-3-fluoropyridine-2-sulfonamide?
The canonical SMILES for N-(2-bromocyclopentyl)-3-fluoropyridine-2-sulfonamide is O=S(=O)(NC1CCCC1Br)c1ncccc1F.
What is the InChIKey of N-(2-bromocyclopentyl)-3-fluoropyridine-2-sulfonamide?
The InChIKey is OXVRCILVASJXBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrFN2O2S/c11-7-3-1-5-9(7)14-17(15,16)10-8(12)4-2-6-13-10/h2,4,6-7,9,14H,1,3,5H2.
What are the key properties of N-(2-bromocyclopentyl)-3-fluoropyridine-2-sulfonamide?
N-(2-bromocyclopentyl)-3-fluoropyridine-2-sulfonamide has a molecular weight of 323.19 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromocyclopentyl)-3-fluoropyridine-2-sulfonamide is sourced from PubChem (CID 103302197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).