4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride

C15H22Cl2N2O3S — CID 141183632

IUPAC4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride
SMILESCl.O=S(=O)(c1ccccc1Cl)N1CCC(N2CCOCC2)CC1
InChIInChI=1S/C15H21ClN2O3S.ClH/c16-14-3-1-2-4-15(14)22(19,20)18-7-5-13(6-8-18)17-9-11-21-12-10-17;/h1-4,13H,5-12H2;1H
InChIKeyKVPSNNOLOPZTBQ-UHFFFAOYSA-N
MW381.33 g/mol
LogP2.25
Rot. Bonds3

About 4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride

4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride (PubChem CID 141183632) has the molecular formula C15H22Cl2N2O3S and a molecular weight of 381.33 g/mol. Its IUPAC name is 4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride.

Molecular Properties

Compound Name4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride
PubChem CID141183632
Molecular FormulaC15H22Cl2N2O3S
Molecular Weight381.33 g/mol
Exact Mass380.07
IUPAC Name4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride
SMILESCl.O=S(=O)(c1ccccc1Cl)N1CCC(N2CCOCC2)CC1
InChIInChI=1S/C15H21ClN2O3S.ClH/c16-14-3-1-2-4-15(14)22(19,20)18-7-5-13(6-8-18)17-9-11-21-12-10-17;/h1-4,13H,5-12H2;1H
InChIKeyKVPSNNOLOPZTBQ-UHFFFAOYSA-N
XLogP2.25
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.33
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride?
The IUPAC name of 4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride (CID 141183632) is 4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride.
What is the SMILES notation for 4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride?
The canonical SMILES for 4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride is Cl.O=S(=O)(c1ccccc1Cl)N1CCC(N2CCOCC2)CC1.
What is the InChIKey of 4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride?
The InChIKey is KVPSNNOLOPZTBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O3S.ClH/c16-14-3-1-2-4-15(14)22(19,20)18-7-5-13(6-8-18)17-9-11-21-12-10-17;/h1-4,13H,5-12H2;1H.
What are the key properties of 4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride?
4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride has a molecular weight of 381.33 g/mol, XLogP of 2.25, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride is sourced from PubChem (CID 141183632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).