N-(5-fluoro-2-piperidin-1-ylphenyl)thiophene-2-sulfonamide

C15H17FN2O2S2 — CID 113092648

IUPACN-(5-fluoro-2-piperidin-1-ylphenyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cc(F)ccc1N1CCCCC1)c1cccs1
InChIInChI=1S/C15H17FN2O2S2/c16-12-6-7-14(18-8-2-1-3-9-18)13(11-12)17-22(19,20)15-5-4-10-21-15/h4-7,10-11,17H,1-3,8-9H2
InChIKeyJEQGISGLRQPCQC-UHFFFAOYSA-N
MW340.44 g/mol
LogP3.68
Rot. Bonds4

About N-(5-fluoro-2-piperidin-1-ylphenyl)thiophene-2-sulfonamide

N-(5-fluoro-2-piperidin-1-ylphenyl)thiophene-2-sulfonamide (PubChem CID 113092648) has the molecular formula C15H17FN2O2S2 and a molecular weight of 340.44 g/mol. Its IUPAC name is N-(5-fluoro-2-piperidin-1-ylphenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(5-fluoro-2-piperidin-1-ylphenyl)thiophene-2-sulfonamide
PubChem CID113092648
Molecular FormulaC15H17FN2O2S2
Molecular Weight340.44 g/mol
Exact Mass340.07
IUPAC NameN-(5-fluoro-2-piperidin-1-ylphenyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cc(F)ccc1N1CCCCC1)c1cccs1
InChIInChI=1S/C15H17FN2O2S2/c16-12-6-7-14(18-8-2-1-3-9-18)13(11-12)17-22(19,20)15-5-4-10-21-15/h4-7,10-11,17H,1-3,8-9H2
InChIKeyJEQGISGLRQPCQC-UHFFFAOYSA-N
XLogP3.68
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.44
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-piperidin-1-ylphenyl)thiophene-2-sulfonamide?
The IUPAC name of N-(5-fluoro-2-piperidin-1-ylphenyl)thiophene-2-sulfonamide (CID 113092648) is N-(5-fluoro-2-piperidin-1-ylphenyl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(5-fluoro-2-piperidin-1-ylphenyl)thiophene-2-sulfonamide?
The canonical SMILES for N-(5-fluoro-2-piperidin-1-ylphenyl)thiophene-2-sulfonamide is O=S(=O)(Nc1cc(F)ccc1N1CCCCC1)c1cccs1.
What is the InChIKey of N-(5-fluoro-2-piperidin-1-ylphenyl)thiophene-2-sulfonamide?
The InChIKey is JEQGISGLRQPCQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O2S2/c16-12-6-7-14(18-8-2-1-3-9-18)13(11-12)17-22(19,20)15-5-4-10-21-15/h4-7,10-11,17H,1-3,8-9H2.
What are the key properties of N-(5-fluoro-2-piperidin-1-ylphenyl)thiophene-2-sulfonamide?
N-(5-fluoro-2-piperidin-1-ylphenyl)thiophene-2-sulfonamide has a molecular weight of 340.44 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-piperidin-1-ylphenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 113092648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).