N-(4-chlorophenyl)-N-ethylethenesulfonamide

C10H12ClNO2S — CID 71476927

IUPACN-(4-chlorophenyl)-N-ethylethenesulfonamide
SMILESC=CS(=O)(=O)N(CC)c1ccc(Cl)cc1
InChIInChI=1S/C10H12ClNO2S/c1-3-12(15(13,14)4-2)10-7-5-9(11)6-8-10/h4-8H,2-3H2,1H3
InChIKeySRWILPAHQTVHJS-UHFFFAOYSA-N
MW245.73 g/mol
LogP2.64
Rot. Bonds4

About N-(4-chlorophenyl)-N-ethylethenesulfonamide

N-(4-chlorophenyl)-N-ethylethenesulfonamide (PubChem CID 71476927) has the molecular formula C10H12ClNO2S and a molecular weight of 245.73 g/mol. Its IUPAC name is N-(4-chlorophenyl)-N-ethylethenesulfonamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-N-ethylethenesulfonamide
PubChem CID71476927
Molecular FormulaC10H12ClNO2S
Molecular Weight245.73 g/mol
Exact Mass245.03
IUPAC NameN-(4-chlorophenyl)-N-ethylethenesulfonamide
SMILESC=CS(=O)(=O)N(CC)c1ccc(Cl)cc1
InChIInChI=1S/C10H12ClNO2S/c1-3-12(15(13,14)4-2)10-7-5-9(11)6-8-10/h4-8H,2-3H2,1H3
InChIKeySRWILPAHQTVHJS-UHFFFAOYSA-N
XLogP2.64
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.73
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-N-ethylethenesulfonamide?
The IUPAC name of N-(4-chlorophenyl)-N-ethylethenesulfonamide (CID 71476927) is N-(4-chlorophenyl)-N-ethylethenesulfonamide.
What is the SMILES notation for N-(4-chlorophenyl)-N-ethylethenesulfonamide?
The canonical SMILES for N-(4-chlorophenyl)-N-ethylethenesulfonamide is C=CS(=O)(=O)N(CC)c1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-N-ethylethenesulfonamide?
The InChIKey is SRWILPAHQTVHJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClNO2S/c1-3-12(15(13,14)4-2)10-7-5-9(11)6-8-10/h4-8H,2-3H2,1H3.
What are the key properties of N-(4-chlorophenyl)-N-ethylethenesulfonamide?
N-(4-chlorophenyl)-N-ethylethenesulfonamide has a molecular weight of 245.73 g/mol, XLogP of 2.64, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-N-ethylethenesulfonamide is sourced from PubChem (CID 71476927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).