N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide

C18H25FN2O3S — CID 3218790

IUPACN-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide
SMILESO=C(NC1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)C1CCCCC1
InChIInChI=1S/C18H25FN2O3S/c19-15-6-8-17(9-7-15)25(23,24)21-12-10-16(11-13-21)20-18(22)14-4-2-1-3-5-14/h6-9,14,16H,1-5,10-13H2,(H,20,22)
InChIKeyPWHFAOBUFQVSOA-UHFFFAOYSA-N
MW368.47 g/mol
LogP2.68
Rot. Bonds4

About N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide

N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide (PubChem CID 3218790) has the molecular formula C18H25FN2O3S and a molecular weight of 368.47 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide
PubChem CID3218790
Molecular FormulaC18H25FN2O3S
Molecular Weight368.47 g/mol
Exact Mass368.16
IUPAC NameN-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide
SMILESO=C(NC1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)C1CCCCC1
InChIInChI=1S/C18H25FN2O3S/c19-15-6-8-17(9-7-15)25(23,24)21-12-10-16(11-13-21)20-18(22)14-4-2-1-3-5-14/h6-9,14,16H,1-5,10-13H2,(H,20,22)
InChIKeyPWHFAOBUFQVSOA-UHFFFAOYSA-N
XLogP2.68
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.47
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide?
The IUPAC name of N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide (CID 3218790) is N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide?
The canonical SMILES for N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide is O=C(NC1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)C1CCCCC1.
What is the InChIKey of N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide?
The InChIKey is PWHFAOBUFQVSOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25FN2O3S/c19-15-6-8-17(9-7-15)25(23,24)21-12-10-16(11-13-21)20-18(22)14-4-2-1-3-5-14/h6-9,14,16H,1-5,10-13H2,(H,20,22).
What are the key properties of N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide?
N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide has a molecular weight of 368.47 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]cyclohexanecarboxamide is sourced from PubChem (CID 3218790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).