N-(1-benzylpiperidin-4-yl)-5-(methylsulfamoyl)furan-2-carboxamide

C18H23N3O4S — CID 39895915

IUPACN-(1-benzylpiperidin-4-yl)-5-(methylsulfamoyl)furan-2-carboxamide
SMILESCNS(=O)(=O)c1ccc(C(=O)NC2CCN(Cc3ccccc3)CC2)o1
InChIInChI=1S/C18H23N3O4S/c1-19-26(23,24)17-8-7-16(25-17)18(22)20-15-9-11-21(12-10-15)13-14-5-3-2-4-6-14/h2-8,15,19H,9-13H2,1H3,(H,20,22)
InChIKeyFOHODTAITQAUIR-UHFFFAOYSA-N
MW377.47 g/mol
LogP1.58
Rot. Bonds6

About N-(1-benzylpiperidin-4-yl)-5-(methylsulfamoyl)furan-2-carboxamide

N-(1-benzylpiperidin-4-yl)-5-(methylsulfamoyl)furan-2-carboxamide (PubChem CID 39895915) has the molecular formula C18H23N3O4S and a molecular weight of 377.47 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)-5-(methylsulfamoyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)-5-(methylsulfamoyl)furan-2-carboxamide
PubChem CID39895915
Molecular FormulaC18H23N3O4S
Molecular Weight377.47 g/mol
Exact Mass377.14
IUPAC NameN-(1-benzylpiperidin-4-yl)-5-(methylsulfamoyl)furan-2-carboxamide
SMILESCNS(=O)(=O)c1ccc(C(=O)NC2CCN(Cc3ccccc3)CC2)o1
InChIInChI=1S/C18H23N3O4S/c1-19-26(23,24)17-8-7-16(25-17)18(22)20-15-9-11-21(12-10-15)13-14-5-3-2-4-6-14/h2-8,15,19H,9-13H2,1H3,(H,20,22)
InChIKeyFOHODTAITQAUIR-UHFFFAOYSA-N
XLogP1.58
TPSA91.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.47
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-[(4-methylphenyl)methyl]piperidin-4-yl]benzamide
CID 2729497
5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide
CID 112530964
1-benzyl-N-methylpiperidin-4-amine
CID 4136128
N-(1-benzylpiperidin-4-yl)-4-bromobenzamide
CID 1103952
N-(1-benzylpiperidin-4-yl)-4-propan-2-ylbenzamide
CID 26681867
N-(1-benzylpiperidin-4-yl)-4-methoxybenzamide
CID 799331
(2S)-2-amino-N-(1-benzylpiperidin-4-yl)propanamide
CID 770488
N-(1-benzylpiperidin-4-yl)-7-bromo-1-benzofuran-2-carboxamide
CID 55688262
(1R)-N-(1-benzylpiperidin-4-yl)-2,2-dichloro-1-methylcyclopropane-1-carboxamide
CID 2712549
N-(1-benzylpiperidin-4-yl)-6-methylpyridine-2-carboxamide
CID 31926879
N-(1-benzylpiperidin-4-yl)-4-[(2-chloroacetyl)amino]benzamide
CID 3044759
N-(1-benzylpiperidin-4-yl)-3-(carbamoylamino)benzamide
CID 29206704

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)-5-(methylsulfamoyl)furan-2-carboxamide?
The IUPAC name of N-(1-benzylpiperidin-4-yl)-5-(methylsulfamoyl)furan-2-carboxamide (CID 39895915) is N-(1-benzylpiperidin-4-yl)-5-(methylsulfamoyl)furan-2-carboxamide.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)-5-(methylsulfamoyl)furan-2-carboxamide?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)-5-(methylsulfamoyl)furan-2-carboxamide is CNS(=O)(=O)c1ccc(C(=O)NC2CCN(Cc3ccccc3)CC2)o1.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)-5-(methylsulfamoyl)furan-2-carboxamide?
The InChIKey is FOHODTAITQAUIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O4S/c1-19-26(23,24)17-8-7-16(25-17)18(22)20-15-9-11-21(12-10-15)13-14-5-3-2-4-6-14/h2-8,15,19H,9-13H2,1H3,(H,20,22).
What are the key properties of N-(1-benzylpiperidin-4-yl)-5-(methylsulfamoyl)furan-2-carboxamide?
N-(1-benzylpiperidin-4-yl)-5-(methylsulfamoyl)furan-2-carboxamide has a molecular weight of 377.47 g/mol, XLogP of 1.58, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)-5-(methylsulfamoyl)furan-2-carboxamide is sourced from PubChem (CID 39895915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).