1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenoxy)piperidine

C15H15ClFNO3S2 — CID 110397007

IUPAC1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenoxy)piperidine
SMILESO=S(=O)(c1ccc(Cl)s1)N1CCC(Oc2ccc(F)cc2)CC1
InChIInChI=1S/C15H15ClFNO3S2/c16-14-5-6-15(22-14)23(19,20)18-9-7-13(8-10-18)21-12-3-1-11(17)2-4-12/h1-6,13H,7-10H2
InChIKeyDZHIIHJLHKSWSQ-UHFFFAOYSA-N
MW375.87 g/mol
LogP3.77
Rot. Bonds4

About 1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenoxy)piperidine

1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenoxy)piperidine (PubChem CID 110397007) has the molecular formula C15H15ClFNO3S2 and a molecular weight of 375.87 g/mol. Its IUPAC name is 1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenoxy)piperidine.

Molecular Properties

Compound Name1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenoxy)piperidine
PubChem CID110397007
Molecular FormulaC15H15ClFNO3S2
Molecular Weight375.87 g/mol
Exact Mass375.02
IUPAC Name1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenoxy)piperidine
SMILESO=S(=O)(c1ccc(Cl)s1)N1CCC(Oc2ccc(F)cc2)CC1
InChIInChI=1S/C15H15ClFNO3S2/c16-14-5-6-15(22-14)23(19,20)18-9-7-13(8-10-18)21-12-3-1-11(17)2-4-12/h1-6,13H,7-10H2
InChIKeyDZHIIHJLHKSWSQ-UHFFFAOYSA-N
XLogP3.77
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.87
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-chlorothiophen-2-yl)sulfonyl-4-(fluoromethyl)piperidine
CID 155976722
1-ethylsulfonyl-4-(4-fluorophenoxy)piperidine
CID 110396981
1-(5-chlorothiophen-2-yl)sulfonylazepane
CID 775842
1-[1-(5-chlorothiophen-2-yl)sulfonylpiperidin-4-yl]ethanone
CID 63846418
1-(5-chlorothiophen-2-yl)sulfonylpiperidine-4-carboxamide
CID 18078359
2-[1-(5-chlorothiophen-2-yl)sulfonylpiperidin-3-yl]oxy-5-fluoropyrimidine
CID 122258636
1-(5-chlorothiophen-2-yl)sulfonyl-4-[(4-methoxyphenyl)sulfanylmethyl]piperidine
CID 71800978
1-(3,4-dimethoxyphenyl)sulfonyl-4-(4-fluorophenoxy)piperidine
CID 110396998
4-benzyl-1-(5-chlorothiophen-2-yl)sulfonylpiperidine
CID 2943089
1-(5-chlorothiophen-2-yl)sulfonyl-N'-hydroxypiperidine-4-carboximidamide
CID 77039217
3-[(3R)-1-(5-chlorothiophen-2-yl)sulfonylpyrrolidin-3-yl]oxypyridazine
CID 100624540
1-(5-ethylthiophen-2-yl)sulfonyl-4-[(4-fluorophenoxy)methyl]piperidine
CID 110639091

Frequently Asked Questions

What is the IUPAC name of 1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenoxy)piperidine?
The IUPAC name of 1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenoxy)piperidine (CID 110397007) is 1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenoxy)piperidine.
What is the SMILES notation for 1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenoxy)piperidine?
The canonical SMILES for 1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenoxy)piperidine is O=S(=O)(c1ccc(Cl)s1)N1CCC(Oc2ccc(F)cc2)CC1.
What is the InChIKey of 1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenoxy)piperidine?
The InChIKey is DZHIIHJLHKSWSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClFNO3S2/c16-14-5-6-15(22-14)23(19,20)18-9-7-13(8-10-18)21-12-3-1-11(17)2-4-12/h1-6,13H,7-10H2.
What are the key properties of 1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenoxy)piperidine?
1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenoxy)piperidine has a molecular weight of 375.87 g/mol, XLogP of 3.77, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chlorothiophen-2-yl)sulfonyl-4-(4-fluorophenoxy)piperidine is sourced from PubChem (CID 110397007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).