3-phenyl-N-piperidin-1-ylsulfonylfuran-2-carboxamide

C16H18N2O4S — CID 71887653

IUPAC3-phenyl-N-piperidin-1-ylsulfonylfuran-2-carboxamide
SMILESO=C(NS(=O)(=O)N1CCCCC1)c1occc1-c1ccccc1
InChIInChI=1S/C16H18N2O4S/c19-16(17-23(20,21)18-10-5-2-6-11-18)15-14(9-12-22-15)13-7-3-1-4-8-13/h1,3-4,7-9,12H,2,5-6,10-11H2,(H,17,19)
InChIKeyXHSDPUNWIBAGTJ-UHFFFAOYSA-N
MW334.40 g/mol
LogP2.41
Rot. Bonds4

About 3-phenyl-N-piperidin-1-ylsulfonylfuran-2-carboxamide

3-phenyl-N-piperidin-1-ylsulfonylfuran-2-carboxamide (PubChem CID 71887653) has the molecular formula C16H18N2O4S and a molecular weight of 334.40 g/mol. Its IUPAC name is 3-phenyl-N-piperidin-1-ylsulfonylfuran-2-carboxamide.

Molecular Properties

Compound Name3-phenyl-N-piperidin-1-ylsulfonylfuran-2-carboxamide
PubChem CID71887653
Molecular FormulaC16H18N2O4S
Molecular Weight334.40 g/mol
Exact Mass334.10
IUPAC Name3-phenyl-N-piperidin-1-ylsulfonylfuran-2-carboxamide
SMILESO=C(NS(=O)(=O)N1CCCCC1)c1occc1-c1ccccc1
InChIInChI=1S/C16H18N2O4S/c19-16(17-23(20,21)18-10-5-2-6-11-18)15-14(9-12-22-15)13-7-3-1-4-8-13/h1,3-4,7-9,12H,2,5-6,10-11H2,(H,17,19)
InChIKeyXHSDPUNWIBAGTJ-UHFFFAOYSA-N
XLogP2.41
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-bromo-N-piperidin-1-ylsulfonylfuran-2-carboxamide
CID 71859634
N-cyclooctyl-3-phenylfuran-2-carboxamide
CID 35163513
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-3-phenylfuran-2-carboxamide
CID 107847366
(2S)-3-hydroxy-2-[(3-phenylfuran-2-carbonyl)amino]propanoic acid
CID 61152901
[2-(hydroxymethyl)piperidin-1-yl]-(3-phenylfuran-2-yl)methanone
CID 43421115
[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl] 3-phenylfuran-2-carboxylate
CID 46641233
N-(3-ethynylphenyl)-3-phenylfuran-2-carboxamide
CID 24676336
3-phenyl-N-[2-(4-phenylpiperazin-1-yl)ethyl]furan-2-carboxamide
CID 30885160
N-[1-(3-phenylfuran-2-carbonyl)piperidin-3-yl]methanesulfonamide
CID 51079183
N,N-diethyl-4-(3-phenylfuran-2-carbonyl)piperazine-1-sulfonamide
CID 29285075
N-[1-(3-phenylfuran-2-carbonyl)piperidin-4-yl]benzamide
CID 30545510
2-[(azocan-1-ylsulfonylamino)methyl]furan-3-carboxylic acid
CID 166295198

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-N-piperidin-1-ylsulfonylfuran-2-carboxamide?
The IUPAC name of 3-phenyl-N-piperidin-1-ylsulfonylfuran-2-carboxamide (CID 71887653) is 3-phenyl-N-piperidin-1-ylsulfonylfuran-2-carboxamide.
What is the SMILES notation for 3-phenyl-N-piperidin-1-ylsulfonylfuran-2-carboxamide?
The canonical SMILES for 3-phenyl-N-piperidin-1-ylsulfonylfuran-2-carboxamide is O=C(NS(=O)(=O)N1CCCCC1)c1occc1-c1ccccc1.
What is the InChIKey of 3-phenyl-N-piperidin-1-ylsulfonylfuran-2-carboxamide?
The InChIKey is XHSDPUNWIBAGTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4S/c19-16(17-23(20,21)18-10-5-2-6-11-18)15-14(9-12-22-15)13-7-3-1-4-8-13/h1,3-4,7-9,12H,2,5-6,10-11H2,(H,17,19).
What are the key properties of 3-phenyl-N-piperidin-1-ylsulfonylfuran-2-carboxamide?
3-phenyl-N-piperidin-1-ylsulfonylfuran-2-carboxamide has a molecular weight of 334.40 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-N-piperidin-1-ylsulfonylfuran-2-carboxamide is sourced from PubChem (CID 71887653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).