1-(diethylsulfamoyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide

C15H25N3O4S — CID 4649989

IUPAC1-(diethylsulfamoyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide
SMILESCCN(CC)S(=O)(=O)N1CCC(C(=O)NCc2ccco2)CC1
InChIInChI=1S/C15H25N3O4S/c1-3-17(4-2)23(20,21)18-9-7-13(8-10-18)15(19)16-12-14-6-5-11-22-14/h5-6,11,13H,3-4,7-10,12H2,1-2H3,(H,16,19)
InChIKeyJGZGPUASQKPYFA-UHFFFAOYSA-N
MW343.45 g/mol
LogP1.19
Rot. Bonds7

About 1-(diethylsulfamoyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide

1-(diethylsulfamoyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide (PubChem CID 4649989) has the molecular formula C15H25N3O4S and a molecular weight of 343.45 g/mol. Its IUPAC name is 1-(diethylsulfamoyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(diethylsulfamoyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide
PubChem CID4649989
Molecular FormulaC15H25N3O4S
Molecular Weight343.45 g/mol
Exact Mass343.16
IUPAC Name1-(diethylsulfamoyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide
SMILESCCN(CC)S(=O)(=O)N1CCC(C(=O)NCc2ccco2)CC1
InChIInChI=1S/C15H25N3O4S/c1-3-17(4-2)23(20,21)18-9-7-13(8-10-18)15(19)16-12-14-6-5-11-22-14/h5-6,11,13H,3-4,7-10,12H2,1-2H3,(H,16,19)
InChIKeyJGZGPUASQKPYFA-UHFFFAOYSA-N
XLogP1.19
TPSA82.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.45
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(diethylsulfamoyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide?
The IUPAC name of 1-(diethylsulfamoyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide (CID 4649989) is 1-(diethylsulfamoyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(diethylsulfamoyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(diethylsulfamoyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide is CCN(CC)S(=O)(=O)N1CCC(C(=O)NCc2ccco2)CC1.
What is the InChIKey of 1-(diethylsulfamoyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide?
The InChIKey is JGZGPUASQKPYFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O4S/c1-3-17(4-2)23(20,21)18-9-7-13(8-10-18)15(19)16-12-14-6-5-11-22-14/h5-6,11,13H,3-4,7-10,12H2,1-2H3,(H,16,19).
What are the key properties of 1-(diethylsulfamoyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide?
1-(diethylsulfamoyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide has a molecular weight of 343.45 g/mol, XLogP of 1.19, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(diethylsulfamoyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide is sourced from PubChem (CID 4649989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).