1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide

C17H19FN2O4S — CID 31817470

IUPAC1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide
SMILESO=C(c1ccoc1)N1CCC(NS(=O)(=O)Cc2ccc(F)cc2)CC1
InChIInChI=1S/C17H19FN2O4S/c18-15-3-1-13(2-4-15)12-25(22,23)19-16-5-8-20(9-6-16)17(21)14-7-10-24-11-14/h1-4,7,10-11,16,19H,5-6,8-9,12H2
InChIKeyXGQODQSKRLWFSP-UHFFFAOYSA-N
MW366.41 g/mol
LogP2.14
Rot. Bonds5

About 1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide

1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide (PubChem CID 31817470) has the molecular formula C17H19FN2O4S and a molecular weight of 366.41 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide
PubChem CID31817470
Molecular FormulaC17H19FN2O4S
Molecular Weight366.41 g/mol
Exact Mass366.10
IUPAC Name1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide
SMILESO=C(c1ccoc1)N1CCC(NS(=O)(=O)Cc2ccc(F)cc2)CC1
InChIInChI=1S/C17H19FN2O4S/c18-15-3-1-13(2-4-15)12-25(22,23)19-16-5-8-20(9-6-16)17(21)14-7-10-24-11-14/h1-4,7,10-11,16,19H,5-6,8-9,12H2
InChIKeyXGQODQSKRLWFSP-UHFFFAOYSA-N
XLogP2.14
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.41
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-fluoro-N-[[1-(furan-3-carbonyl)piperidin-4-yl]methyl]benzenesulfonamide
CID 90521856
N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide
CID 110820123
N-[1-(furan-3-carbonyl)piperidin-4-yl]-4-(trifluoromethyl)benzenesulfonamide
CID 31817197
3-[(4-fluorophenyl)methylsulfonylamino]cyclopentane-1-carboxylic acid
CID 66031746
N-[1-[4-(aminomethyl)benzoyl]piperidin-4-yl]-4-fluorobenzenesulfonamide;hydrochloride
CID 119294484
tert-butyl (3S)-3-[(4-fluorophenyl)methylsulfonylamino]piperidine-1-carboxylate
CID 97171780
N-[1-(furan-3-carbonyl)piperidin-4-yl]-2-methylpropanamide
CID 38198075
5-bromo-N-[1-(furan-3-carbonyl)piperidin-4-yl]furan-2-carboxamide
CID 38198333
[4-(4-fluoro-2-nitroanilino)piperidin-1-yl]-(furan-3-yl)methanone
CID 31660157
N-[2-[1-(4-fluorobenzoyl)piperidin-4-yl]ethyl]-1-phenylmethanesulfonamide
CID 53103748
[3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone
CID 71809262
4-(oxolan-3-ylsulfamoylmethyl)benzoic acid
CID 80716794

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide?
The IUPAC name of 1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide (CID 31817470) is 1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide.
What is the SMILES notation for 1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide?
The canonical SMILES for 1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide is O=C(c1ccoc1)N1CCC(NS(=O)(=O)Cc2ccc(F)cc2)CC1.
What is the InChIKey of 1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide?
The InChIKey is XGQODQSKRLWFSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O4S/c18-15-3-1-13(2-4-15)12-25(22,23)19-16-5-8-20(9-6-16)17(21)14-7-10-24-11-14/h1-4,7,10-11,16,19H,5-6,8-9,12H2.
What are the key properties of 1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide?
1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide has a molecular weight of 366.41 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide is sourced from PubChem (CID 31817470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).