2-fluoro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide

C18H19FN2O3S — CID 7759853

IUPAC2-fluoro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide
SMILESO=C(Nc1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccc1F
InChIInChI=1S/C18H19FN2O3S/c19-17-10-3-2-9-16(17)18(22)20-14-7-6-8-15(13-14)25(23,24)21-11-4-1-5-12-21/h2-3,6-10,13H,1,4-5,11-12H2,(H,20,22)
InChIKeyYYLHKPSYXJAPQI-UHFFFAOYSA-N
MW362.43 g/mol
LogP3.25
Rot. Bonds4

About 2-fluoro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide

2-fluoro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide (PubChem CID 7759853) has the molecular formula C18H19FN2O3S and a molecular weight of 362.43 g/mol. Its IUPAC name is 2-fluoro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide.

Molecular Properties

Compound Name2-fluoro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide
PubChem CID7759853
Molecular FormulaC18H19FN2O3S
Molecular Weight362.43 g/mol
Exact Mass362.11
IUPAC Name2-fluoro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide
SMILESO=C(Nc1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccc1F
InChIInChI=1S/C18H19FN2O3S/c19-17-10-3-2-9-16(17)18(22)20-14-7-6-8-15(13-14)25(23,24)21-11-4-1-5-12-21/h2-3,6-10,13H,1,4-5,11-12H2,(H,20,22)
InChIKeyYYLHKPSYXJAPQI-UHFFFAOYSA-N
XLogP3.25
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-difluoro-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 26252564
2-fluoro-N-(4-piperidin-1-ylsulfonylphenyl)benzamide
CID 1086858
2-fluoro-N-(2-fluoro-4-piperidin-1-ylsulfonylphenyl)benzamide
CID 18893328
2,3-dichloro-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 42991910
2-methoxy-N-(3-piperidin-1-ylsulfonylphenyl)benzamide
CID 7759835
2-fluoro-N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)benzamide
CID 7695778
N-[3-(azepan-1-ylsulfonyl)phenyl]-2-chloro-5-methylsulfanylbenzamide
CID 26523987
2,4-difluoro-N-[3-oxo-3-(3-piperidin-1-ylsulfonylanilino)propyl]benzamide
CID 30668165
2-fluoro-N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)benzamide
CID 4799979
7-fluoro-3-methyl-N-(3-piperidin-1-ylsulfonylphenyl)-1-benzofuran-2-carboxamide
CID 31009311
5-(azepan-1-ylsulfonyl)-N-(4-chlorophenyl)-2-fluorobenzamide
CID 4085587
N-[3-(azepan-1-ylsulfonyl)phenyl]-2-oxochromene-3-carboxamide
CID 3566147

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide?
The IUPAC name of 2-fluoro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide (CID 7759853) is 2-fluoro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide.
What is the SMILES notation for 2-fluoro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide?
The canonical SMILES for 2-fluoro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide is O=C(Nc1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide?
The InChIKey is YYLHKPSYXJAPQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O3S/c19-17-10-3-2-9-16(17)18(22)20-14-7-6-8-15(13-14)25(23,24)21-11-4-1-5-12-21/h2-3,6-10,13H,1,4-5,11-12H2,(H,20,22).
What are the key properties of 2-fluoro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide?
2-fluoro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide has a molecular weight of 362.43 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide is sourced from PubChem (CID 7759853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).