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1-ethyl-4-[4-(2-methoxyphenoxy)phenyl]sulfonylpiperazine

C19H24N2O4S — CID 1190535

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC1-ethyl-4-[4-(2-methoxyphenoxy)phenyl]sulfonylpiperazine
SMILESCCN1CCN(S(=O)(=O)c2ccc(Oc3ccccc3OC)cc2)CC1
InChIInChI=1S/C19H24N2O4S/c1-3-20-12-14-21(15-13-20)26(22,23)17-10-8-16(9-11-17)25-19-7-5-4-6-18(19)24-2/h4-11H,3,12-15H2,1-2H3
InChIKeyTUOHPINRADNWIR-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.81
Rot. Bonds6

About 1-ethyl-4-[4-(2-methoxyphenoxy)phenyl]sulfonylpiperazine

1-ethyl-4-[4-(2-methoxyphenoxy)phenyl]sulfonylpiperazine (PubChem CID 1190535) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is 1-ethyl-4-[4-(2-methoxyphenoxy)phenyl]sulfonylpiperazine.

Molecular Properties

Compound Name1-ethyl-4-[4-(2-methoxyphenoxy)phenyl]sulfonylpiperazine
PubChem CID1190535
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Name1-ethyl-4-[4-(2-methoxyphenoxy)phenyl]sulfonylpiperazine
SMILESCCN1CCN(S(=O)(=O)c2ccc(Oc3ccccc3OC)cc2)CC1
InChIInChI=1S/C19H24N2O4S/c1-3-20-12-14-21(15-13-20)26(22,23)17-10-8-16(9-11-17)25-19-7-5-4-6-18(19)24-2/h4-11H,3,12-15H2,1-2H3
InChIKeyTUOHPINRADNWIR-UHFFFAOYSA-N
XLogP2.81
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[4-(2-methoxyphenoxy)phenyl]sulfonylpiperazine?
The IUPAC name of 1-ethyl-4-[4-(2-methoxyphenoxy)phenyl]sulfonylpiperazine (CID 1190535) is 1-ethyl-4-[4-(2-methoxyphenoxy)phenyl]sulfonylpiperazine.
What is the SMILES notation for 1-ethyl-4-[4-(2-methoxyphenoxy)phenyl]sulfonylpiperazine?
The canonical SMILES for 1-ethyl-4-[4-(2-methoxyphenoxy)phenyl]sulfonylpiperazine is CCN1CCN(S(=O)(=O)c2ccc(Oc3ccccc3OC)cc2)CC1.
What is the InChIKey of 1-ethyl-4-[4-(2-methoxyphenoxy)phenyl]sulfonylpiperazine?
The InChIKey is TUOHPINRADNWIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-3-20-12-14-21(15-13-20)26(22,23)17-10-8-16(9-11-17)25-19-7-5-4-6-18(19)24-2/h4-11H,3,12-15H2,1-2H3.
What are the key properties of 1-ethyl-4-[4-(2-methoxyphenoxy)phenyl]sulfonylpiperazine?
1-ethyl-4-[4-(2-methoxyphenoxy)phenyl]sulfonylpiperazine has a molecular weight of 376.48 g/mol, XLogP of 2.81, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[4-(2-methoxyphenoxy)phenyl]sulfonylpiperazine is sourced from PubChem (CID 1190535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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