1-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]methanesulfonamide

C15H15ClFNO2S — CID 2987124

IUPAC1-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]methanesulfonamide
SMILESO=S(=O)(Cc1ccccc1Cl)NCCc1ccc(F)cc1
InChIInChI=1S/C15H15ClFNO2S/c16-15-4-2-1-3-13(15)11-21(19,20)18-10-9-12-5-7-14(17)8-6-12/h1-8,18H,9-11H2
InChIKeyWFJAHSKHJLWEQG-UHFFFAOYSA-N
MW327.81 g/mol
LogP3.14
Rot. Bonds6

About 1-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]methanesulfonamide

1-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]methanesulfonamide (PubChem CID 2987124) has the molecular formula C15H15ClFNO2S and a molecular weight of 327.81 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]methanesulfonamide.

Molecular Properties

Compound Name1-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]methanesulfonamide
PubChem CID2987124
Molecular FormulaC15H15ClFNO2S
Molecular Weight327.81 g/mol
Exact Mass327.05
IUPAC Name1-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]methanesulfonamide
SMILESO=S(=O)(Cc1ccccc1Cl)NCCc1ccc(F)cc1
InChIInChI=1S/C15H15ClFNO2S/c16-15-4-2-1-3-13(15)11-21(19,20)18-10-9-12-5-7-14(17)8-6-12/h1-8,18H,9-11H2
InChIKeyWFJAHSKHJLWEQG-UHFFFAOYSA-N
XLogP3.14
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.81
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]methanesulfonamide?
The IUPAC name of 1-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]methanesulfonamide (CID 2987124) is 1-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]methanesulfonamide.
What is the SMILES notation for 1-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]methanesulfonamide?
The canonical SMILES for 1-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]methanesulfonamide is O=S(=O)(Cc1ccccc1Cl)NCCc1ccc(F)cc1.
What is the InChIKey of 1-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]methanesulfonamide?
The InChIKey is WFJAHSKHJLWEQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClFNO2S/c16-15-4-2-1-3-13(15)11-21(19,20)18-10-9-12-5-7-14(17)8-6-12/h1-8,18H,9-11H2.
What are the key properties of 1-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]methanesulfonamide?
1-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]methanesulfonamide has a molecular weight of 327.81 g/mol, XLogP of 3.14, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]methanesulfonamide is sourced from PubChem (CID 2987124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).