N-(4-chloro-2-iodophenyl)-5-fluoropyridine-3-sulfonamide

C11H7ClFIN2O2S — CID 103763977

IUPACN-(4-chloro-2-iodophenyl)-5-fluoropyridine-3-sulfonamide
SMILESO=S(=O)(Nc1ccc(Cl)cc1I)c1cncc(F)c1
InChIInChI=1S/C11H7ClFIN2O2S/c12-7-1-2-11(10(14)3-7)16-19(17,18)9-4-8(13)5-15-6-9/h1-6,16H
InChIKeyRYUKSERAAOUZPO-UHFFFAOYSA-N
MW412.61 g/mol
LogP3.28
Rot. Bonds3

About N-(4-chloro-2-iodophenyl)-5-fluoropyridine-3-sulfonamide

N-(4-chloro-2-iodophenyl)-5-fluoropyridine-3-sulfonamide (PubChem CID 103763977) has the molecular formula C11H7ClFIN2O2S and a molecular weight of 412.61 g/mol. Its IUPAC name is N-(4-chloro-2-iodophenyl)-5-fluoropyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(4-chloro-2-iodophenyl)-5-fluoropyridine-3-sulfonamide
PubChem CID103763977
Molecular FormulaC11H7ClFIN2O2S
Molecular Weight412.61 g/mol
Exact Mass411.89
IUPAC NameN-(4-chloro-2-iodophenyl)-5-fluoropyridine-3-sulfonamide
SMILESO=S(=O)(Nc1ccc(Cl)cc1I)c1cncc(F)c1
InChIInChI=1S/C11H7ClFIN2O2S/c12-7-1-2-11(10(14)3-7)16-19(17,18)9-4-8(13)5-15-6-9/h1-6,16H
InChIKeyRYUKSERAAOUZPO-UHFFFAOYSA-N
XLogP3.28
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.61
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-chloro-2-iodophenyl)-2-(methylamino)pyrimidine-5-sulfonamide
CID 107630680
3-amino-N-(4-chloro-2-iodophenyl)-4-fluoro-5-methylbenzenesulfonamide
CID 107624621
3,4-difluoro-N-(4-fluoro-2-iodophenyl)benzenesulfonamide
CID 79766974
N-(4-chloro-2-iodophenyl)-4-methoxybenzenesulfonamide
CID 103764001
4-(bromomethyl)-N-(4-chloro-2-iodophenyl)benzenesulfonamide
CID 107629608
4-amino-N-(4-chloro-2-iodophenyl)-3-methylbenzenesulfonamide
CID 107624554
4-acetyl-N-(4-chloro-2-iodophenyl)benzenesulfonamide
CID 103763982
N-(4-chloro-2-iodophenyl)-2-deuterio-1,3-benzothiazole-6-sulfonamide
CID 146309108
3-amino-5-chloro-N-(4-chloro-2-iodophenyl)-2-fluorobenzenesulfonamide
CID 107624597
4-[(5-fluoro-3-pyridinyl)sulfonylamino]benzoic acid
CID 56828319
3-chloro-N-(5-fluoro-3-pyridinyl)benzenesulfonamide
CID 110872403
N-(4-chloro-2-iodophenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 113257304

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-iodophenyl)-5-fluoropyridine-3-sulfonamide?
The IUPAC name of N-(4-chloro-2-iodophenyl)-5-fluoropyridine-3-sulfonamide (CID 103763977) is N-(4-chloro-2-iodophenyl)-5-fluoropyridine-3-sulfonamide.
What is the SMILES notation for N-(4-chloro-2-iodophenyl)-5-fluoropyridine-3-sulfonamide?
The canonical SMILES for N-(4-chloro-2-iodophenyl)-5-fluoropyridine-3-sulfonamide is O=S(=O)(Nc1ccc(Cl)cc1I)c1cncc(F)c1.
What is the InChIKey of N-(4-chloro-2-iodophenyl)-5-fluoropyridine-3-sulfonamide?
The InChIKey is RYUKSERAAOUZPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClFIN2O2S/c12-7-1-2-11(10(14)3-7)16-19(17,18)9-4-8(13)5-15-6-9/h1-6,16H.
What are the key properties of N-(4-chloro-2-iodophenyl)-5-fluoropyridine-3-sulfonamide?
N-(4-chloro-2-iodophenyl)-5-fluoropyridine-3-sulfonamide has a molecular weight of 412.61 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-iodophenyl)-5-fluoropyridine-3-sulfonamide is sourced from PubChem (CID 103763977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).