N-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide

C14H16FN3O2S — CID 103303892

IUPACN-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide
SMILESCCCNc1cccnc1S(=O)(=O)Nc1cccc(F)c1
InChIInChI=1S/C14H16FN3O2S/c1-2-8-16-13-7-4-9-17-14(13)21(19,20)18-12-6-3-5-11(15)10-12/h3-7,9-10,16,18H,2,8H2,1H3
InChIKeyKXOXNSZIXZLANB-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.84
Rot. Bonds6

About N-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide

N-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide (PubChem CID 103303892) has the molecular formula C14H16FN3O2S and a molecular weight of 309.37 g/mol. Its IUPAC name is N-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide
PubChem CID103303892
Molecular FormulaC14H16FN3O2S
Molecular Weight309.37 g/mol
Exact Mass309.09
IUPAC NameN-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide
SMILESCCCNc1cccnc1S(=O)(=O)Nc1cccc(F)c1
InChIInChI=1S/C14H16FN3O2S/c1-2-8-16-13-7-4-9-17-14(13)21(19,20)18-12-6-3-5-11(15)10-12/h3-7,9-10,16,18H,2,8H2,1H3
InChIKeyKXOXNSZIXZLANB-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

N-(3-fluorophenyl)-2-(propylamino)benzenesulfonamide
CID 62143114
3-(propylamino)-N-pyrimidin-2-ylpyridine-2-sulfonamide
CID 103303452
N-methyl-3-(propylamino)pyridine-2-sulfonamide
CID 103303712
3-(propylamino)-N-pyridin-2-ylpyridine-2-sulfonamide
CID 103303743
N-ethyl-3-(propylamino)pyridine-2-sulfonamide
CID 103303728
N-(2,2-difluoroethyl)-3-(propylamino)pyridine-2-sulfonamide
CID 103306685
N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103304014
N-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103303922
N-(5-methyl-2-pyridinyl)-3-(propylamino)pyridine-2-sulfonamide
CID 103303494
N-(3-ethylpentan-3-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103306299
N-(3-chloro-4-methylphenyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103303101
N-(4-methylpentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103304534

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide?
The IUPAC name of N-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide (CID 103303892) is N-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide.
What is the SMILES notation for N-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide?
The canonical SMILES for N-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide is CCCNc1cccnc1S(=O)(=O)Nc1cccc(F)c1.
What is the InChIKey of N-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide?
The InChIKey is KXOXNSZIXZLANB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O2S/c1-2-8-16-13-7-4-9-17-14(13)21(19,20)18-12-6-3-5-11(15)10-12/h3-7,9-10,16,18H,2,8H2,1H3.
What are the key properties of N-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide?
N-(3-fluorophenyl)-3-(propylamino)pyridine-2-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-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide is sourced from PubChem (CID 103303892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).