4-(furan-2-ylmethylsulfamoyl)-N-(5-piperidin-1-yl-2-pyridinyl)benzamide

C22H24N4O4S — CID 78878198

IUPAC4-(furan-2-ylmethylsulfamoyl)-N-(5-piperidin-1-yl-2-pyridinyl)benzamide
SMILESO=C(Nc1ccc(N2CCCCC2)cn1)c1ccc(S(=O)(=O)NCc2ccco2)cc1
InChIInChI=1S/C22H24N4O4S/c27-22(25-21-11-8-18(15-23-21)26-12-2-1-3-13-26)17-6-9-20(10-7-17)31(28,29)24-16-19-5-4-14-30-19/h4-11,14-15,24H,1-3,12-13,16H2,(H,23,25,27)
InChIKeyDWYWYEIPWLHYIF-UHFFFAOYSA-N
MW440.53 g/mol
LogP3.40
Rot. Bonds7

About 4-(furan-2-ylmethylsulfamoyl)-N-(5-piperidin-1-yl-2-pyridinyl)benzamide

4-(furan-2-ylmethylsulfamoyl)-N-(5-piperidin-1-yl-2-pyridinyl)benzamide (PubChem CID 78878198) has the molecular formula C22H24N4O4S and a molecular weight of 440.53 g/mol. Its IUPAC name is 4-(furan-2-ylmethylsulfamoyl)-N-(5-piperidin-1-yl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name4-(furan-2-ylmethylsulfamoyl)-N-(5-piperidin-1-yl-2-pyridinyl)benzamide
PubChem CID78878198
Molecular FormulaC22H24N4O4S
Molecular Weight440.53 g/mol
Exact Mass440.15
IUPAC Name4-(furan-2-ylmethylsulfamoyl)-N-(5-piperidin-1-yl-2-pyridinyl)benzamide
SMILESO=C(Nc1ccc(N2CCCCC2)cn1)c1ccc(S(=O)(=O)NCc2ccco2)cc1
InChIInChI=1S/C22H24N4O4S/c27-22(25-21-11-8-18(15-23-21)26-12-2-1-3-13-26)17-6-9-20(10-7-17)31(28,29)24-16-19-5-4-14-30-19/h4-11,14-15,24H,1-3,12-13,16H2,(H,23,25,27)
InChIKeyDWYWYEIPWLHYIF-UHFFFAOYSA-N
XLogP3.40
TPSA104.54 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.53
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(furan-2-ylmethyl)-4-piperidin-1-ylbenzamide
CID 53282405
N-(4-chlorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 2687824
4-[(4-methylphenyl)sulfonylmethyl]-N-(5-piperidin-1-yl-2-pyridinyl)benzamide
CID 78899579
4-methyl-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide
CID 32947923
N-(4,5-dihydro-1,3-thiazol-2-yl)-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 7534970
1-N-(furan-2-ylmethyl)-4-N-(4-pyrrolidin-1-ylphenyl)benzene-1,4-dicarboxamide
CID 109046634
N-[5-(azepan-1-yl)-2-pyridinyl]-4-methoxybenzamide
CID 39072257
N-(2,3-dihydro-1H-inden-5-yl)-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 26864849
4-(furan-2-ylmethylsulfamoyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)benzamide
CID 18274021
[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl] 4-(furan-2-ylmethylsulfamoyl)benzoate
CID 8663364
4-(furan-2-ylmethylsulfamoyl)-N-[(4-pyrazol-1-ylphenyl)methyl]benzamide
CID 55699972
4-(furan-2-ylmethylsulfamoyl)-N-[(2R)-2-phenyl-2-pyrrolidin-1-ylethyl]benzamide
CID 27800512

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-ylmethylsulfamoyl)-N-(5-piperidin-1-yl-2-pyridinyl)benzamide?
The IUPAC name of 4-(furan-2-ylmethylsulfamoyl)-N-(5-piperidin-1-yl-2-pyridinyl)benzamide (CID 78878198) is 4-(furan-2-ylmethylsulfamoyl)-N-(5-piperidin-1-yl-2-pyridinyl)benzamide.
What is the SMILES notation for 4-(furan-2-ylmethylsulfamoyl)-N-(5-piperidin-1-yl-2-pyridinyl)benzamide?
The canonical SMILES for 4-(furan-2-ylmethylsulfamoyl)-N-(5-piperidin-1-yl-2-pyridinyl)benzamide is O=C(Nc1ccc(N2CCCCC2)cn1)c1ccc(S(=O)(=O)NCc2ccco2)cc1.
What is the InChIKey of 4-(furan-2-ylmethylsulfamoyl)-N-(5-piperidin-1-yl-2-pyridinyl)benzamide?
The InChIKey is DWYWYEIPWLHYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O4S/c27-22(25-21-11-8-18(15-23-21)26-12-2-1-3-13-26)17-6-9-20(10-7-17)31(28,29)24-16-19-5-4-14-30-19/h4-11,14-15,24H,1-3,12-13,16H2,(H,23,25,27).
What are the key properties of 4-(furan-2-ylmethylsulfamoyl)-N-(5-piperidin-1-yl-2-pyridinyl)benzamide?
4-(furan-2-ylmethylsulfamoyl)-N-(5-piperidin-1-yl-2-pyridinyl)benzamide has a molecular weight of 440.53 g/mol, XLogP of 3.40, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-ylmethylsulfamoyl)-N-(5-piperidin-1-yl-2-pyridinyl)benzamide is sourced from PubChem (CID 78878198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).