N-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide

C14H16FN3O2S — CID 62145210

IUPACN-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide
SMILESCCCNc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cn1
InChIInChI=1S/C14H16FN3O2S/c1-2-9-16-14-8-7-13(10-17-14)21(19,20)18-12-5-3-11(15)4-6-12/h3-8,10,18H,2,9H2,1H3,(H,16,17)
InChIKeyBZOOIFVYXABGOL-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.84
Rot. Bonds6

About N-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide

N-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide (PubChem CID 62145210) has the molecular formula C14H16FN3O2S and a molecular weight of 309.37 g/mol. Its IUPAC name is N-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide
PubChem CID62145210
Molecular FormulaC14H16FN3O2S
Molecular Weight309.37 g/mol
Exact Mass309.09
IUPAC NameN-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide
SMILESCCCNc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cn1
InChIInChI=1S/C14H16FN3O2S/c1-2-9-16-14-8-7-13(10-17-14)21(19,20)18-12-5-3-11(15)4-6-12/h3-8,10,18H,2,9H2,1H3,(H,16,17)
InChIKeyBZOOIFVYXABGOL-UHFFFAOYSA-N
XLogP2.84
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(ethylamino)-N-(4-fluorophenyl)pyridine-3-sulfonamide
CID 62145209
6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide
CID 62147845
N-[5-(butylamino)-2-pyridinyl]-4-fluorobenzenesulfonamide
CID 113024035
6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide
CID 66354410
4-bromo-N-[5-(propylamino)-2-pyridinyl]benzenesulfonamide
CID 113023499
N-(2-iodophenyl)-6-(propylamino)pyridine-3-sulfonamide
CID 62143908
4-chloro-3-methyl-N-[6-(propylamino)-3-pyridinyl]benzenesulfonamide
CID 113009140
6-(propylamino)-N-pyrazin-2-ylpyridine-3-sulfonamide
CID 62147379
N-[6-(propylamino)-3-pyridinyl]-1,3-benzodioxole-5-sulfonamide
CID 113009130
2-oxo-N-[6-(propylamino)-3-pyridinyl]-1,3-dihydroindole-5-sulfonamide
CID 113009145
6-(propylamino)-N-(thiatriazol-5-yl)pyridine-3-sulfonamide
CID 114914131
6-(propylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
CID 116787796

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide?
The IUPAC name of N-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide (CID 62145210) is N-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide.
What is the SMILES notation for N-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide?
The canonical SMILES for N-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide is CCCNc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cn1.
What is the InChIKey of N-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide?
The InChIKey is BZOOIFVYXABGOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O2S/c1-2-9-16-14-8-7-13(10-17-14)21(19,20)18-12-5-3-11(15)4-6-12/h3-8,10,18H,2,9H2,1H3,(H,16,17).
What are the key properties of N-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide?
N-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide has a molecular weight of 309.37 g/mol, XLogP of 2.84, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide is sourced from PubChem (CID 62145210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).