5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide

C13H15N3O4S — CID 39898259

IUPAC5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
SMILESCNS(=O)(=O)c1ccc(C(=O)NCCc2ccccn2)o1
InChIInChI=1S/C13H15N3O4S/c1-14-21(18,19)12-6-5-11(20-12)13(17)16-9-7-10-4-2-3-8-15-10/h2-6,8,14H,7,9H2,1H3,(H,16,17)
InChIKeyPWHABXZZOBALPV-UHFFFAOYSA-N
MW309.35 g/mol
LogP0.56
Rot. Bonds6

About 5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide

5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide (PubChem CID 39898259) has the molecular formula C13H15N3O4S and a molecular weight of 309.35 g/mol. Its IUPAC name is 5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
PubChem CID39898259
Molecular FormulaC13H15N3O4S
Molecular Weight309.35 g/mol
Exact Mass309.08
IUPAC Name5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
SMILESCNS(=O)(=O)c1ccc(C(=O)NCCc2ccccn2)o1
InChIInChI=1S/C13H15N3O4S/c1-14-21(18,19)12-6-5-11(20-12)13(17)16-9-7-10-4-2-3-8-15-10/h2-6,8,14H,7,9H2,1H3,(H,16,17)
InChIKeyPWHABXZZOBALPV-UHFFFAOYSA-N
XLogP0.56
TPSA101.30 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.35
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
CID 32623665
N-[2-(ethylamino)ethyl]-5-(methylsulfamoyl)furan-2-carboxamide
CID 119509422
5-(2-fluorophenyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
CID 51180762
5-(methylsulfamoyl)-N-(3,3,3-trifluoropropyl)furan-2-carboxamide
CID 112527770
ethane;2-methyl-N-(2-pyridin-2-ylethyl)propanamide
CID 142112887
5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
CID 42850852
4-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 81235207
5-bromo-N-[3-oxo-3-(pyridin-2-ylmethylamino)propyl]furan-2-carboxamide
CID 3237599
(2R)-2-methylsulfonyl-N-(2-pyridin-2-ylethyl)propanamide
CID 94025060
5-(tert-butylsulfamoyl)-N-[3-(pyridin-2-ylmethylcarbamoyl)phenyl]furan-2-carboxamide
CID 55783720
2-chloro-N-(2-pyridin-2-ylethyl)propanamide
CID 24692533
4-(tert-butylsulfamoyl)-N-(2-pyridin-2-ylethyl)benzamide
CID 31528348

Frequently Asked Questions

What is the IUPAC name of 5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide?
The IUPAC name of 5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide (CID 39898259) is 5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide.
What is the SMILES notation for 5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide?
The canonical SMILES for 5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide is CNS(=O)(=O)c1ccc(C(=O)NCCc2ccccn2)o1.
What is the InChIKey of 5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide?
The InChIKey is PWHABXZZOBALPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O4S/c1-14-21(18,19)12-6-5-11(20-12)13(17)16-9-7-10-4-2-3-8-15-10/h2-6,8,14H,7,9H2,1H3,(H,16,17).
What are the key properties of 5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide?
5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide has a molecular weight of 309.35 g/mol, XLogP of 0.56, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide is sourced from PubChem (CID 39898259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).