N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]furan-2-carboxamide

C13H15N3O4S — CID 44995255

IUPACN-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]furan-2-carboxamide
SMILESO=C(NCCS(=O)(=O)NCc1cccnc1)c1ccco1
InChIInChI=1S/C13H15N3O4S/c17-13(12-4-2-7-20-12)15-6-8-21(18,19)16-10-11-3-1-5-14-9-11/h1-5,7,9,16H,6,8,10H2,(H,15,17)
InChIKeyVQQIGNZFSIFZNX-UHFFFAOYSA-N
MW309.35 g/mol
LogP0.52
Rot. Bonds7

About N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]furan-2-carboxamide

N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]furan-2-carboxamide (PubChem CID 44995255) has the molecular formula C13H15N3O4S and a molecular weight of 309.35 g/mol. Its IUPAC name is N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]furan-2-carboxamide
PubChem CID44995255
Molecular FormulaC13H15N3O4S
Molecular Weight309.35 g/mol
Exact Mass309.08
IUPAC NameN-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]furan-2-carboxamide
SMILESO=C(NCCS(=O)(=O)NCc1cccnc1)c1ccco1
InChIInChI=1S/C13H15N3O4S/c17-13(12-4-2-7-20-12)15-6-8-21(18,19)16-10-11-3-1-5-14-9-11/h1-5,7,9,16H,6,8,10H2,(H,15,17)
InChIKeyVQQIGNZFSIFZNX-UHFFFAOYSA-N
XLogP0.52
TPSA101.30 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.35
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-fluoro-N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]benzamide
CID 7618448
N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]thiophene-2-carboxamide
CID 44995257
N-[4-oxo-4-(pyridin-3-ylmethylamino)butyl]furan-2-carboxamide
CID 35511874
3-phenyl-N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]benzamide
CID 110345177
2-(propan-2-ylamino)-N-(pyridin-3-ylmethyl)ethanesulfonamide
CID 54973657
N-[4-oxo-4-[4-(pyridin-3-ylmethyl)piperazin-1-yl]butyl]furan-2-carboxamide
CID 134045130
N-(pyridin-3-ylmethylsulfamoyl)benzamide
CID 142724613
3-(propylamino)-N-(pyridin-3-ylmethyl)propane-1-sulfonamide
CID 106030719
4-(furan-2-ylmethylsulfamoyl)-N-(pyridin-3-ylmethyl)benzamide
CID 24538489
N-[2-(3-pyridin-3-yl-1H-1,2,4-triazol-5-yl)ethyl]furan-2-carboxamide
CID 126468371
N-[10-(furan-2-carbonylamino)decyl]furan-2-carboxamide
CID 3147438
N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide
CID 113027750

Frequently Asked Questions

What is the IUPAC name of N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]furan-2-carboxamide?
The IUPAC name of N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]furan-2-carboxamide (CID 44995255) is N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]furan-2-carboxamide is O=C(NCCS(=O)(=O)NCc1cccnc1)c1ccco1.
What is the InChIKey of N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]furan-2-carboxamide?
The InChIKey is VQQIGNZFSIFZNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O4S/c17-13(12-4-2-7-20-12)15-6-8-21(18,19)16-10-11-3-1-5-14-9-11/h1-5,7,9,16H,6,8,10H2,(H,15,17).
What are the key properties of N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]furan-2-carboxamide?
N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]furan-2-carboxamide has a molecular weight of 309.35 g/mol, XLogP of 0.52, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(pyridin-3-ylmethylsulfamoyl)ethyl]furan-2-carboxamide is sourced from PubChem (CID 44995255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).