1-(4-chlorophenyl)sulfonylpiperidine

C11H14ClNO2S — CID 965266

IUPAC1-(4-chlorophenyl)sulfonylpiperidine
SMILESO=S(=O)(c1ccc(Cl)cc1)N1CCCCC1
InChIInChI=1S/C11H14ClNO2S/c12-10-4-6-11(7-5-10)16(14,15)13-8-2-1-3-9-13/h4-7H,1-3,8-9H2
InChIKeyNTLYJFLDDJOJCB-UHFFFAOYSA-N
MW259.76 g/mol
LogP2.51
Rot. Bonds2

About 1-(4-chlorophenyl)sulfonylpiperidine

1-(4-chlorophenyl)sulfonylpiperidine (PubChem CID 965266) has the molecular formula C11H14ClNO2S and a molecular weight of 259.76 g/mol. Its IUPAC name is 1-(4-chlorophenyl)sulfonylpiperidine.

Molecular Properties

Compound Name1-(4-chlorophenyl)sulfonylpiperidine
PubChem CID965266
Molecular FormulaC11H14ClNO2S
Molecular Weight259.76 g/mol
Exact Mass259.04
IUPAC Name1-(4-chlorophenyl)sulfonylpiperidine
SMILESO=S(=O)(c1ccc(Cl)cc1)N1CCCCC1
InChIInChI=1S/C11H14ClNO2S/c12-10-4-6-11(7-5-10)16(14,15)13-8-2-1-3-9-13/h4-7H,1-3,8-9H2
InChIKeyNTLYJFLDDJOJCB-UHFFFAOYSA-N
XLogP2.51
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.76
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-Chlorobenzenesulfonyl)piperazine
CID 801806
Benzenesulfonamide, 4-chloro-N,N-dimethyl-
CID 81967
1-(Phenylsulfonyl)piperidine
CID 78733
4-Chloro-N-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide
CID 2735724
4-(4-Chloro-benzenesulfonyl)-morpholine
CID 255686
1-(4-Chlorophenyl)sulfonyl-4-methylpiperazine
CID 754318
1-(4-Chlorophenyl)sulfonylazepane
CID 822517
4-Chloro-N-methyl-N-(1-methyl-piperidin-4-yl)-benzenesulfonamide
CID 1129292
Piperidine, 1-[(2,5-dichlorophenyl)sulfonyl]-
CID 646492
4-Benzyl-1-[(4-chlorophenyl)sulfonyl]piperidine
CID 710407
1-[(4-chlorophenyl)sulfonyl]tetrahydro-4(1H)-pyridinone
CID 3364429
N,N-Dibutyl-4-chlorobenzenesulfonamide
CID 31385

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)sulfonylpiperidine?
The IUPAC name of 1-(4-chlorophenyl)sulfonylpiperidine (CID 965266) is 1-(4-chlorophenyl)sulfonylpiperidine.
What is the SMILES notation for 1-(4-chlorophenyl)sulfonylpiperidine?
The canonical SMILES for 1-(4-chlorophenyl)sulfonylpiperidine is O=S(=O)(c1ccc(Cl)cc1)N1CCCCC1.
What is the InChIKey of 1-(4-chlorophenyl)sulfonylpiperidine?
The InChIKey is NTLYJFLDDJOJCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO2S/c12-10-4-6-11(7-5-10)16(14,15)13-8-2-1-3-9-13/h4-7H,1-3,8-9H2.
What are the key properties of 1-(4-chlorophenyl)sulfonylpiperidine?
1-(4-chlorophenyl)sulfonylpiperidine has a molecular weight of 259.76 g/mol, XLogP of 2.51, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)sulfonylpiperidine is sourced from PubChem (CID 965266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).