2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide

C14H16FN3O2S — CID 62143671

IUPAC2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)Nc2ccc(C)c(F)c2)ccn1
InChIInChI=1S/C14H16FN3O2S/c1-3-16-14-9-12(6-7-17-14)21(19,20)18-11-5-4-10(2)13(15)8-11/h4-9,18H,3H2,1-2H3,(H,16,17)
InChIKeyKCBIOECOHYGVIN-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.76
Rot. Bonds5

About 2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide

2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide (PubChem CID 62143671) has the molecular formula C14H16FN3O2S and a molecular weight of 309.37 g/mol. Its IUPAC name is 2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide
PubChem CID62143671
Molecular FormulaC14H16FN3O2S
Molecular Weight309.37 g/mol
Exact Mass309.09
IUPAC Name2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)Nc2ccc(C)c(F)c2)ccn1
InChIInChI=1S/C14H16FN3O2S/c1-3-16-14-9-12(6-7-17-14)21(19,20)18-11-5-4-10(2)13(15)8-11/h4-9,18H,3H2,1-2H3,(H,16,17)
InChIKeyKCBIOECOHYGVIN-UHFFFAOYSA-N
XLogP2.76
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-bromo-3-fluorophenyl)-2-(ethylamino)pyridine-4-sulfonamide
CID 65436624
N-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide
CID 62148688
N-(4-fluoro-3-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide
CID 62811577
N-(4-fluoro-3-methylphenyl)-2-hydrazinylpyridine-4-sulfonamide
CID 62812201
2-(ethylamino)-N-propan-2-ylpyridine-4-sulfonamide
CID 62149834
N-(3,4-difluorophenyl)-2-hydrazinylpyridine-4-sulfonamide
CID 61004703
2-(ethylamino)-N-(3-ethylpentan-3-yl)pyridine-4-sulfonamide
CID 65042331
4-ethoxy-N-(3-fluoro-4-methylphenyl)benzenesulfonamide
CID 2121784
2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide
CID 62162458
N-(2-bromo-4-methylphenyl)-2-(ethylamino)pyridine-4-sulfonamide
CID 62164386
N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-(ethylamino)pyridine-4-sulfonamide
CID 65481175
3-(aminomethyl)-N-(3-fluoro-4-methylphenyl)-4-methylbenzenesulfonamide
CID 107482637

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide?
The IUPAC name of 2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide (CID 62143671) is 2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide.
What is the SMILES notation for 2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide?
The canonical SMILES for 2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide is CCNc1cc(S(=O)(=O)Nc2ccc(C)c(F)c2)ccn1.
What is the InChIKey of 2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide?
The InChIKey is KCBIOECOHYGVIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O2S/c1-3-16-14-9-12(6-7-17-14)21(19,20)18-11-5-4-10(2)13(15)8-11/h4-9,18H,3H2,1-2H3,(H,16,17).
What are the key properties of 2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide?
2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide has a molecular weight of 309.37 g/mol, XLogP of 2.76, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide is sourced from PubChem (CID 62143671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).