N-(3,5-difluorophenyl)-6-[1-(furan-2-yl)ethylamino]pyridine-3-sulfonamide

C17H15F2N3O3S — CID 133358492

IUPACN-(3,5-difluorophenyl)-6-[1-(furan-2-yl)ethylamino]pyridine-3-sulfonamide
SMILESCC(Nc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1)c1ccco1
InChIInChI=1S/C17H15F2N3O3S/c1-11(16-3-2-6-25-16)21-17-5-4-15(10-20-17)26(23,24)22-14-8-12(18)7-13(19)9-14/h2-11,22H,1H3,(H,20,21)
InChIKeySIKVBVNYVLJCFM-UHFFFAOYSA-N
MW379.39 g/mol
LogP3.93
Rot. Bonds6

About N-(3,5-difluorophenyl)-6-[1-(furan-2-yl)ethylamino]pyridine-3-sulfonamide

N-(3,5-difluorophenyl)-6-[1-(furan-2-yl)ethylamino]pyridine-3-sulfonamide (PubChem CID 133358492) has the molecular formula C17H15F2N3O3S and a molecular weight of 379.39 g/mol. Its IUPAC name is N-(3,5-difluorophenyl)-6-[1-(furan-2-yl)ethylamino]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(3,5-difluorophenyl)-6-[1-(furan-2-yl)ethylamino]pyridine-3-sulfonamide
PubChem CID133358492
Molecular FormulaC17H15F2N3O3S
Molecular Weight379.39 g/mol
Exact Mass379.08
IUPAC NameN-(3,5-difluorophenyl)-6-[1-(furan-2-yl)ethylamino]pyridine-3-sulfonamide
SMILESCC(Nc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1)c1ccco1
InChIInChI=1S/C17H15F2N3O3S/c1-11(16-3-2-6-25-16)21-17-5-4-15(10-20-17)26(23,24)22-14-8-12(18)7-13(19)9-14/h2-11,22H,1H3,(H,20,21)
InChIKeySIKVBVNYVLJCFM-UHFFFAOYSA-N
XLogP3.93
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.39
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,5-difluorophenyl)-6-(1-thiophen-2-ylethylamino)pyridine-3-sulfonamide
CID 133372819
N-tert-butyl-2-[[5-[(3,5-difluorophenyl)sulfamoyl]-2-pyridinyl]amino]propanamide
CID 133351813
N-[1-(furan-2-yl)ethyl]-6-(methylamino)pyridine-3-sulfonamide
CID 62147836
N-(3-fluorophenyl)-6-(methylamino)pyridine-3-sulfonamide
CID 62142755
N-(3,5-difluorophenyl)-6-[(2-hydroxy-2-methylpropyl)amino]pyridine-3-sulfonamide
CID 133351839
N-[2-[[5-[(3,5-difluorophenyl)sulfamoyl]-2-pyridinyl]amino]ethyl]acetamide
CID 133352522
N-[1-(furan-2-yl)ethyl]-5-(trifluoromethyl)pyridin-2-amine
CID 43399613
N-(3,5-dichloro-4-fluorophenyl)-6-(methylamino)pyridine-3-sulfonamide
CID 107578094
N-(3,5-difluorophenyl)-6-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]pyridine-3-sulfonamide
CID 133314068
N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine
CID 103932113
N-(3,5-difluorophenyl)-6-[(1-methyltriazol-4-yl)methylamino]pyridine-3-sulfonamide
CID 166208303
N-(3,4-difluorophenyl)-6-[(1-hydroxy-4-methylpentan-2-yl)amino]pyridine-3-sulfonamide
CID 133355206

Frequently Asked Questions

What is the IUPAC name of N-(3,5-difluorophenyl)-6-[1-(furan-2-yl)ethylamino]pyridine-3-sulfonamide?
The IUPAC name of N-(3,5-difluorophenyl)-6-[1-(furan-2-yl)ethylamino]pyridine-3-sulfonamide (CID 133358492) is N-(3,5-difluorophenyl)-6-[1-(furan-2-yl)ethylamino]pyridine-3-sulfonamide.
What is the SMILES notation for N-(3,5-difluorophenyl)-6-[1-(furan-2-yl)ethylamino]pyridine-3-sulfonamide?
The canonical SMILES for N-(3,5-difluorophenyl)-6-[1-(furan-2-yl)ethylamino]pyridine-3-sulfonamide is CC(Nc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1)c1ccco1.
What is the InChIKey of N-(3,5-difluorophenyl)-6-[1-(furan-2-yl)ethylamino]pyridine-3-sulfonamide?
The InChIKey is SIKVBVNYVLJCFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F2N3O3S/c1-11(16-3-2-6-25-16)21-17-5-4-15(10-20-17)26(23,24)22-14-8-12(18)7-13(19)9-14/h2-11,22H,1H3,(H,20,21).
What are the key properties of N-(3,5-difluorophenyl)-6-[1-(furan-2-yl)ethylamino]pyridine-3-sulfonamide?
N-(3,5-difluorophenyl)-6-[1-(furan-2-yl)ethylamino]pyridine-3-sulfonamide has a molecular weight of 379.39 g/mol, XLogP of 3.93, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-difluorophenyl)-6-[1-(furan-2-yl)ethylamino]pyridine-3-sulfonamide is sourced from PubChem (CID 133358492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).