1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol

C11H13ClFNO3S — CID 43394316

IUPAC1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol
SMILESO=S(=O)(c1ccc(Cl)cc1F)N1CCC(O)CC1
InChIInChI=1S/C11H13ClFNO3S/c12-8-1-2-11(10(13)7-8)18(16,17)14-5-3-9(15)4-6-14/h1-2,7,9,15H,3-6H2
InChIKeyROBHGRWWEQFIOJ-UHFFFAOYSA-N
MW293.75 g/mol
LogP1.62
Rot. Bonds2

About 1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol

1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol (PubChem CID 43394316) has the molecular formula C11H13ClFNO3S and a molecular weight of 293.75 g/mol. Its IUPAC name is 1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol.

Molecular Properties

Compound Name1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol
PubChem CID43394316
Molecular FormulaC11H13ClFNO3S
Molecular Weight293.75 g/mol
Exact Mass293.03
IUPAC Name1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol
SMILESO=S(=O)(c1ccc(Cl)cc1F)N1CCC(O)CC1
InChIInChI=1S/C11H13ClFNO3S/c12-8-1-2-11(10(13)7-8)18(16,17)14-5-3-9(15)4-6-14/h1-2,7,9,15H,3-6H2
InChIKeyROBHGRWWEQFIOJ-UHFFFAOYSA-N
XLogP1.62
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.75
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-chloro-2-fluorophenyl)sulfonylpiperidine-4-carbaldehyde
CID 63844683
1-[4-chloro-2-(trifluoromethyl)phenyl]sulfonylpiperidin-4-ol
CID 43394334
(3S,4R)-1-(4-chloro-2-fluorophenyl)sulfonylpyrrolidine-3,4-diol
CID 79410117
1-(4-chloro-2-fluorophenyl)sulfonylpiperidine
CID 60639529
1-(2,4-dichlorophenyl)sulfonylpyrrolidin-3-ol
CID 77144746
(3S)-1-(2,4-dichlorophenyl)sulfonylpyrrolidin-3-ol
CID 98008354
1-(4-chloro-2-fluorophenyl)sulfonyl-N-methylpyrrolidin-3-amine;hydrochloride
CID 119963060
(3R)-1-(2-chloro-4-fluorophenyl)sulfonylpyrrolidin-3-ol
CID 66291100
(3S)-1-[4-chloro-2-(trifluoromethyl)phenyl]sulfonylpyrrolidin-3-ol
CID 79031548
1-(4-chloro-2-fluorophenyl)sulfonyl-4-(4-methylphenyl)sulfonylpiperazine
CID 55352164
1-(4-chloro-2-fluorophenyl)sulfonylpiperidine-3-carbaldehyde
CID 63845886
1-(4-chloro-2-fluorophenyl)sulfonylpiperidine-3-carboxamide
CID 18086440

Frequently Asked Questions

What is the IUPAC name of 1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol?
The IUPAC name of 1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol (CID 43394316) is 1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol.
What is the SMILES notation for 1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol?
The canonical SMILES for 1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol is O=S(=O)(c1ccc(Cl)cc1F)N1CCC(O)CC1.
What is the InChIKey of 1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol?
The InChIKey is ROBHGRWWEQFIOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClFNO3S/c12-8-1-2-11(10(13)7-8)18(16,17)14-5-3-9(15)4-6-14/h1-2,7,9,15H,3-6H2.
What are the key properties of 1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol?
1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol has a molecular weight of 293.75 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chloro-2-fluorophenyl)sulfonylpiperidin-4-ol is sourced from PubChem (CID 43394316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).