4-[1-(3,4-dichlorophenyl)sulfonylpiperidin-4-yl]morpholine

C15H20Cl2N2O3S — CID 68554209

IUPAC4-[1-(3,4-dichlorophenyl)sulfonylpiperidin-4-yl]morpholine
SMILESO=S(=O)(c1ccc(Cl)c(Cl)c1)N1CCC(N2CCOCC2)CC1
InChIInChI=1S/C15H20Cl2N2O3S/c16-14-2-1-13(11-15(14)17)23(20,21)19-5-3-12(4-6-19)18-7-9-22-10-8-18/h1-2,11-12H,3-10H2
InChIKeyBDYRYDCRLNQRJC-UHFFFAOYSA-N
MW379.31 g/mol
LogP2.48
Rot. Bonds3

About 4-[1-(3,4-dichlorophenyl)sulfonylpiperidin-4-yl]morpholine

4-[1-(3,4-dichlorophenyl)sulfonylpiperidin-4-yl]morpholine (PubChem CID 68554209) has the molecular formula C15H20Cl2N2O3S and a molecular weight of 379.31 g/mol. Its IUPAC name is 4-[1-(3,4-dichlorophenyl)sulfonylpiperidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[1-(3,4-dichlorophenyl)sulfonylpiperidin-4-yl]morpholine
PubChem CID68554209
Molecular FormulaC15H20Cl2N2O3S
Molecular Weight379.31 g/mol
Exact Mass378.06
IUPAC Name4-[1-(3,4-dichlorophenyl)sulfonylpiperidin-4-yl]morpholine
SMILESO=S(=O)(c1ccc(Cl)c(Cl)c1)N1CCC(N2CCOCC2)CC1
InChIInChI=1S/C15H20Cl2N2O3S/c16-14-2-1-13(11-15(14)17)23(20,21)19-5-3-12(4-6-19)18-7-9-22-10-8-18/h1-2,11-12H,3-10H2
InChIKeyBDYRYDCRLNQRJC-UHFFFAOYSA-N
XLogP2.48
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.31
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclohexyl-4-(3,4-dichlorophenyl)sulfonylpiperazine
CID 23738911
4-bromo-1-(3,4-dichlorophenyl)sulfonylpiperidine
CID 80672110
4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine
CID 11950053
4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine;hydrochloride
CID 141183632
4-[1-[4-(trifluoromethoxy)phenyl]sulfonylpiperidin-4-yl]morpholine
CID 118314272
5-(3-morpholin-4-ylpyrrolidin-1-yl)sulfonylpyridin-2-amine
CID 63174663
1-(3,4-dichlorophenyl)sulfonyl-N-methylpiperidin-4-amine;hydrochloride
CID 119980298
3-(3-morpholin-4-ylpyrrolidin-1-yl)sulfonylphenol
CID 81265123
2-chloro-4-morpholin-4-ylsulfonylphenol
CID 3821405
4-[[1-(3-chloro-4-fluorophenyl)sulfonylpiperidin-4-yl]methyl]morpholine
CID 60540053
3-chloro-1-(3,4-dichlorophenyl)sulfonylpiperidine
CID 63397150
4-[(3R)-1-[[6-(trifluoromethyl)-3-pyridinyl]sulfonyl]pyrrolidin-3-yl]morpholine
CID 129398340

Frequently Asked Questions

What is the IUPAC name of 4-[1-(3,4-dichlorophenyl)sulfonylpiperidin-4-yl]morpholine?
The IUPAC name of 4-[1-(3,4-dichlorophenyl)sulfonylpiperidin-4-yl]morpholine (CID 68554209) is 4-[1-(3,4-dichlorophenyl)sulfonylpiperidin-4-yl]morpholine.
What is the SMILES notation for 4-[1-(3,4-dichlorophenyl)sulfonylpiperidin-4-yl]morpholine?
The canonical SMILES for 4-[1-(3,4-dichlorophenyl)sulfonylpiperidin-4-yl]morpholine is O=S(=O)(c1ccc(Cl)c(Cl)c1)N1CCC(N2CCOCC2)CC1.
What is the InChIKey of 4-[1-(3,4-dichlorophenyl)sulfonylpiperidin-4-yl]morpholine?
The InChIKey is BDYRYDCRLNQRJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2N2O3S/c16-14-2-1-13(11-15(14)17)23(20,21)19-5-3-12(4-6-19)18-7-9-22-10-8-18/h1-2,11-12H,3-10H2.
What are the key properties of 4-[1-(3,4-dichlorophenyl)sulfonylpiperidin-4-yl]morpholine?
4-[1-(3,4-dichlorophenyl)sulfonylpiperidin-4-yl]morpholine has a molecular weight of 379.31 g/mol, XLogP of 2.48, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(3,4-dichlorophenyl)sulfonylpiperidin-4-yl]morpholine is sourced from PubChem (CID 68554209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).