N-cyclohexyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide

C19H27FN2O3S — CID 27670600

IUPACN-cyclohexyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide
SMILESCN(C(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1)C1CCCCC1
InChIInChI=1S/C19H27FN2O3S/c1-21(16-7-3-2-4-8-16)19(23)15-11-13-22(14-12-15)26(24,25)18-10-6-5-9-17(18)20/h5-6,9-10,15-16H,2-4,7-8,11-14H2,1H3
InChIKeyLLZCEAGDJSXUER-UHFFFAOYSA-N
MW382.50 g/mol
LogP3.02
Rot. Bonds4

About N-cyclohexyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide

N-cyclohexyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide (PubChem CID 27670600) has the molecular formula C19H27FN2O3S and a molecular weight of 382.50 g/mol. Its IUPAC name is N-cyclohexyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide
PubChem CID27670600
Molecular FormulaC19H27FN2O3S
Molecular Weight382.50 g/mol
Exact Mass382.17
IUPAC NameN-cyclohexyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide
SMILESCN(C(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1)C1CCCCC1
InChIInChI=1S/C19H27FN2O3S/c1-21(16-7-3-2-4-8-16)19(23)15-11-13-22(14-12-15)26(24,25)18-10-6-5-9-17(18)20/h5-6,9-10,15-16H,2-4,7-8,11-14H2,1H3
InChIKeyLLZCEAGDJSXUER-UHFFFAOYSA-N
XLogP3.02
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.50
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-cyclohexyl-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-methylpropanamide
CID 8512708
N-benzyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide
CID 27665709
1-(4-chlorophenyl)sulfonyl-N-cyclohexyl-N-methylpiperidine-4-carboxamide
CID 27670607
N-[(2-chloro-6-fluorophenyl)methyl]-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide
CID 30278857
N-benzyl-1-(2-fluorophenyl)sulfonyl-N-propylpiperidine-4-carboxamide
CID 26292191
N-cyclohexyl-1-(3,4-dimethylphenyl)sulfonyl-N-methylpiperidine-4-carboxamide
CID 51147994
1-(2-fluorophenyl)sulfonyl-N-methyl-N-(naphthalen-2-ylmethyl)piperidine-4-carboxamide
CID 17493112
N-[(5-bromo-2-fluorophenyl)methyl]-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide
CID 55580678
1-(2-fluorophenyl)sulfonyl-N-methyl-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide
CID 78770763
N-cyclopentyl-N-methyl-1-sulfamoylpiperidine-4-carboxamide
CID 47184100
N-ethyl-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide
CID 40630207
1-(2-fluorophenyl)sulfonyl-4-pyrrolidin-1-ylpiperidine
CID 51892276

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide?
The IUPAC name of N-cyclohexyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide (CID 27670600) is N-cyclohexyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide?
The canonical SMILES for N-cyclohexyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide is CN(C(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide?
The InChIKey is LLZCEAGDJSXUER-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27FN2O3S/c1-21(16-7-3-2-4-8-16)19(23)15-11-13-22(14-12-15)26(24,25)18-10-6-5-9-17(18)20/h5-6,9-10,15-16H,2-4,7-8,11-14H2,1H3.
What are the key properties of N-cyclohexyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide?
N-cyclohexyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide has a molecular weight of 382.50 g/mol, XLogP of 3.02, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 27670600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).