N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide

C16H17FN2O4S — CID 24793463

IUPACN-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide
SMILESO=C(NC1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)c1ccco1
InChIInChI=1S/C16H17FN2O4S/c17-12-3-5-14(6-4-12)24(21,22)19-9-7-13(8-10-19)18-16(20)15-2-1-11-23-15/h1-6,11,13H,7-10H2,(H,18,20)
InChIKeyYZWQUCMJEIHLNI-UHFFFAOYSA-N
MW352.39 g/mol
LogP2.00
Rot. Bonds4

About N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide

N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide (PubChem CID 24793463) has the molecular formula C16H17FN2O4S and a molecular weight of 352.39 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide
PubChem CID24793463
Molecular FormulaC16H17FN2O4S
Molecular Weight352.39 g/mol
Exact Mass352.09
IUPAC NameN-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide
SMILESO=C(NC1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)c1ccco1
InChIInChI=1S/C16H17FN2O4S/c17-12-3-5-14(6-4-12)24(21,22)19-9-7-13(8-10-19)18-16(20)15-2-1-11-23-15/h1-6,11,13H,7-10H2,(H,18,20)
InChIKeyYZWQUCMJEIHLNI-UHFFFAOYSA-N
XLogP2.00
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-3-methylfuran-2-carboxamide
CID 47090079
N-[1-(2,5-dimethylphenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide
CID 108559603
N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-2-methylbenzamide
CID 3218791
N-[1-(4-bromophenyl)sulfonylpiperidin-4-yl]-4-fluorobenzamide
CID 35400948
N-(1-methylsulfonylpyrrolidin-3-yl)furan-2-carboxamide
CID 110871255
N-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]furan-2-carboxamide
CID 75537873
N-(1-benzylpiperidin-4-yl)-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide
CID 27673196
N-cyclooctylfuran-2-carboxamide
CID 790432
N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]furan-2-carboxamide
CID 16930286
N-[1-(furan-2-carbonyl)piperidin-4-yl]-4-[(3R)-3-methylpiperidin-1-yl]sulfonylbenzamide
CID 42015638
N-[2-(furan-2-carbonylamino)ethyl]-1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxamide
CID 38225023
3,4-difluoro-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]benzamide
CID 24617746

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide?
The IUPAC name of N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide (CID 24793463) is N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide?
The canonical SMILES for N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide is O=C(NC1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)c1ccco1.
What is the InChIKey of N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide?
The InChIKey is YZWQUCMJEIHLNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O4S/c17-12-3-5-14(6-4-12)24(21,22)19-9-7-13(8-10-19)18-16(20)15-2-1-11-23-15/h1-6,11,13H,7-10H2,(H,18,20).
What are the key properties of N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide?
N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide has a molecular weight of 352.39 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]furan-2-carboxamide is sourced from PubChem (CID 24793463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).