N-cyclohexyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide

C18H25FN2O3S — CID 3158860

IUPACN-cyclohexyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide
SMILESO=C(NC1CCCCC1)C1CCCN(S(=O)(=O)c2ccc(F)cc2)C1
InChIInChI=1S/C18H25FN2O3S/c19-15-8-10-17(11-9-15)25(23,24)21-12-4-5-14(13-21)18(22)20-16-6-2-1-3-7-16/h8-11,14,16H,1-7,12-13H2,(H,20,22)
InChIKeyUVLGJZPPRMVHOJ-UHFFFAOYSA-N
MW368.47 g/mol
LogP2.68
Rot. Bonds4

About N-cyclohexyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide

N-cyclohexyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide (PubChem CID 3158860) has the molecular formula C18H25FN2O3S and a molecular weight of 368.47 g/mol. Its IUPAC name is N-cyclohexyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide
PubChem CID3158860
Molecular FormulaC18H25FN2O3S
Molecular Weight368.47 g/mol
Exact Mass368.16
IUPAC NameN-cyclohexyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide
SMILESO=C(NC1CCCCC1)C1CCCN(S(=O)(=O)c2ccc(F)cc2)C1
InChIInChI=1S/C18H25FN2O3S/c19-15-8-10-17(11-9-15)25(23,24)21-12-4-5-14(13-21)18(22)20-16-6-2-1-3-7-16/h8-11,14,16H,1-7,12-13H2,(H,20,22)
InChIKeyUVLGJZPPRMVHOJ-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

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide?
The IUPAC name of N-cyclohexyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide (CID 3158860) is N-cyclohexyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide is O=C(NC1CCCCC1)C1CCCN(S(=O)(=O)c2ccc(F)cc2)C1.
What is the InChIKey of N-cyclohexyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide?
The InChIKey is UVLGJZPPRMVHOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25FN2O3S/c19-15-8-10-17(11-9-15)25(23,24)21-12-4-5-14(13-21)18(22)20-16-6-2-1-3-7-16/h8-11,14,16H,1-7,12-13H2,(H,20,22).
What are the key properties of N-cyclohexyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide?
N-cyclohexyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide 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-cyclohexyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide is sourced from PubChem (CID 3158860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).