N-(furan-3-ylmethyl)-N-methyl-6-oxo-1H-pyridine-3-sulfonamide

C11H12N2O4S — CID 61422679

IUPACN-(furan-3-ylmethyl)-N-methyl-6-oxo-1H-pyridine-3-sulfonamide
SMILESCN(Cc1ccoc1)S(=O)(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C11H12N2O4S/c1-13(7-9-4-5-17-8-9)18(15,16)10-2-3-11(14)12-6-10/h2-6,8H,7H2,1H3,(H,12,14)
InChIKeyRPHPCHPNJHFHTI-UHFFFAOYSA-N
MW268.29 g/mol
LogP0.79
Rot. Bonds4

About N-(furan-3-ylmethyl)-N-methyl-6-oxo-1H-pyridine-3-sulfonamide

N-(furan-3-ylmethyl)-N-methyl-6-oxo-1H-pyridine-3-sulfonamide (PubChem CID 61422679) has the molecular formula C11H12N2O4S and a molecular weight of 268.29 g/mol. Its IUPAC name is N-(furan-3-ylmethyl)-N-methyl-6-oxo-1H-pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(furan-3-ylmethyl)-N-methyl-6-oxo-1H-pyridine-3-sulfonamide
PubChem CID61422679
Molecular FormulaC11H12N2O4S
Molecular Weight268.29 g/mol
Exact Mass268.05
IUPAC NameN-(furan-3-ylmethyl)-N-methyl-6-oxo-1H-pyridine-3-sulfonamide
SMILESCN(Cc1ccoc1)S(=O)(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C11H12N2O4S/c1-13(7-9-4-5-17-8-9)18(15,16)10-2-3-11(14)12-6-10/h2-6,8H,7H2,1H3,(H,12,14)
InChIKeyRPHPCHPNJHFHTI-UHFFFAOYSA-N
XLogP0.79
TPSA83.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.29
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(Furan-3-ylmethyl)-3-(1-methyl-6-oxo-3-pyridinyl)urea
CID 75462308
N-[3-[methylsulfonyl(propan-2-yl)amino]propyl]furan-3-carboxamide
CID 45824321
N-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide
CID 47285387
2-({[(3-furylmethyl)(methyl)amino]carbonyl}amino)-N,N-dimethylethanesulfonamide
CID 122563561
N-(furan-3-ylmethyl)acetamide
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CID 20745865
N-(furan-3-ylmethyl)-2-methylpropanamide
CID 59833185
N-(furan-3-ylmethyl)-2-methylsulfonylethanamine
CID 63001172
N-(furan-3-ylmethyl)propanamide
CID 68238235
N-[2-(acetylsulfamoyl)ethyl]furan-3-carboxamide
CID 90085547
N-(furan-3-ylmethyl)butanamide
CID 110868877
N-(furan-3-ylmethyl)prop-2-enamide
CID 116376602

Frequently Asked Questions

What is the IUPAC name of N-(furan-3-ylmethyl)-N-methyl-6-oxo-1H-pyridine-3-sulfonamide?
The IUPAC name of N-(furan-3-ylmethyl)-N-methyl-6-oxo-1H-pyridine-3-sulfonamide (CID 61422679) is N-(furan-3-ylmethyl)-N-methyl-6-oxo-1H-pyridine-3-sulfonamide.
What is the SMILES notation for N-(furan-3-ylmethyl)-N-methyl-6-oxo-1H-pyridine-3-sulfonamide?
The canonical SMILES for N-(furan-3-ylmethyl)-N-methyl-6-oxo-1H-pyridine-3-sulfonamide is CN(Cc1ccoc1)S(=O)(=O)c1ccc(=O)[nH]c1.
What is the InChIKey of N-(furan-3-ylmethyl)-N-methyl-6-oxo-1H-pyridine-3-sulfonamide?
The InChIKey is RPHPCHPNJHFHTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O4S/c1-13(7-9-4-5-17-8-9)18(15,16)10-2-3-11(14)12-6-10/h2-6,8H,7H2,1H3,(H,12,14).
What are the key properties of N-(furan-3-ylmethyl)-N-methyl-6-oxo-1H-pyridine-3-sulfonamide?
N-(furan-3-ylmethyl)-N-methyl-6-oxo-1H-pyridine-3-sulfonamide has a molecular weight of 268.29 g/mol, XLogP of 0.79, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-3-ylmethyl)-N-methyl-6-oxo-1H-pyridine-3-sulfonamide is sourced from PubChem (CID 61422679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).