N-(4-ethoxy-2-methylphenyl)-3-fluoropyridine-2-sulfonamide

C14H15FN2O3S — CID 103299321

IUPACN-(4-ethoxy-2-methylphenyl)-3-fluoropyridine-2-sulfonamide
SMILESCCOc1ccc(NS(=O)(=O)c2ncccc2F)c(C)c1
InChIInChI=1S/C14H15FN2O3S/c1-3-20-11-6-7-13(10(2)9-11)17-21(18,19)14-12(15)5-4-8-16-14/h4-9,17H,3H2,1-2H3
InChIKeyRPOSIQUFZHZVMX-UHFFFAOYSA-N
MW310.35 g/mol
LogP2.73
Rot. Bonds5

About N-(4-ethoxy-2-methylphenyl)-3-fluoropyridine-2-sulfonamide

N-(4-ethoxy-2-methylphenyl)-3-fluoropyridine-2-sulfonamide (PubChem CID 103299321) has the molecular formula C14H15FN2O3S and a molecular weight of 310.35 g/mol. Its IUPAC name is N-(4-ethoxy-2-methylphenyl)-3-fluoropyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(4-ethoxy-2-methylphenyl)-3-fluoropyridine-2-sulfonamide
PubChem CID103299321
Molecular FormulaC14H15FN2O3S
Molecular Weight310.35 g/mol
Exact Mass310.08
IUPAC NameN-(4-ethoxy-2-methylphenyl)-3-fluoropyridine-2-sulfonamide
SMILESCCOc1ccc(NS(=O)(=O)c2ncccc2F)c(C)c1
InChIInChI=1S/C14H15FN2O3S/c1-3-20-11-6-7-13(10(2)9-11)17-21(18,19)14-12(15)5-4-8-16-14/h4-9,17H,3H2,1-2H3
InChIKeyRPOSIQUFZHZVMX-UHFFFAOYSA-N
XLogP2.73
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethoxyphenyl)-3-fluoropyridine-2-sulfonamide
CID 103299090
N-(2,5-difluoro-4-methylphenyl)-3-fluoropyridine-2-sulfonamide
CID 103585478
N-(5-chloro-2-ethoxyphenyl)-3-fluoropyridine-2-sulfonamide
CID 103299319
N-(4-ethoxy-2-methylphenyl)ethanesulfonamide
CID 61063373
2,6-difluoro-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)benzenesulfonamide
CID 48628792
3-fluoro-N-(2-fluorophenyl)pyridine-2-sulfonamide
CID 103299037
N-(4-bromo-2-fluorophenyl)-3-fluoropyridine-2-sulfonamide
CID 103299113
N-(4-amino-2,6-dimethylphenyl)-3-fluoropyridine-2-sulfonamide
CID 103298617
N-(2-bromo-5-methylphenyl)-3-fluoropyridine-2-sulfonamide
CID 103300344
N-(2,6-diethylphenyl)-3-fluoropyridine-2-sulfonamide
CID 103299092
N-(4-ethoxy-2-methylphenyl)-3-methyl-1,2-oxazole-4-sulfonamide
CID 126830755
2-[(3-fluoro-2-pyridinyl)sulfonylamino]-5-methylbenzoic acid
CID 103298700

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxy-2-methylphenyl)-3-fluoropyridine-2-sulfonamide?
The IUPAC name of N-(4-ethoxy-2-methylphenyl)-3-fluoropyridine-2-sulfonamide (CID 103299321) is N-(4-ethoxy-2-methylphenyl)-3-fluoropyridine-2-sulfonamide.
What is the SMILES notation for N-(4-ethoxy-2-methylphenyl)-3-fluoropyridine-2-sulfonamide?
The canonical SMILES for N-(4-ethoxy-2-methylphenyl)-3-fluoropyridine-2-sulfonamide is CCOc1ccc(NS(=O)(=O)c2ncccc2F)c(C)c1.
What is the InChIKey of N-(4-ethoxy-2-methylphenyl)-3-fluoropyridine-2-sulfonamide?
The InChIKey is RPOSIQUFZHZVMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O3S/c1-3-20-11-6-7-13(10(2)9-11)17-21(18,19)14-12(15)5-4-8-16-14/h4-9,17H,3H2,1-2H3.
What are the key properties of N-(4-ethoxy-2-methylphenyl)-3-fluoropyridine-2-sulfonamide?
N-(4-ethoxy-2-methylphenyl)-3-fluoropyridine-2-sulfonamide has a molecular weight of 310.35 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxy-2-methylphenyl)-3-fluoropyridine-2-sulfonamide is sourced from PubChem (CID 103299321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).