N-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide

C14H16N2O4S — CID 860463

IUPACN-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide
SMILESCCC(=O)Nc1ccc(S(=O)(=O)NCc2ccco2)cc1
InChIInChI=1S/C14H16N2O4S/c1-2-14(17)16-11-5-7-13(8-6-11)21(18,19)15-10-12-4-3-9-20-12/h3-9,15H,2,10H2,1H3,(H,16,17)
InChIKeyDFOKEQQPYHTMON-UHFFFAOYSA-N
MW308.36 g/mol
LogP2.11
Rot. Bonds6

About N-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide

N-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide (PubChem CID 860463) has the molecular formula C14H16N2O4S and a molecular weight of 308.36 g/mol. Its IUPAC name is N-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide.

Molecular Properties

Compound NameN-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide
PubChem CID860463
Molecular FormulaC14H16N2O4S
Molecular Weight308.36 g/mol
Exact Mass308.08
IUPAC NameN-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide
SMILESCCC(=O)Nc1ccc(S(=O)(=O)NCc2ccco2)cc1
InChIInChI=1S/C14H16N2O4S/c1-2-14(17)16-11-5-7-13(8-6-11)21(18,19)15-10-12-4-3-9-20-12/h3-9,15H,2,10H2,1H3,(H,16,17)
InChIKeyDFOKEQQPYHTMON-UHFFFAOYSA-N
XLogP2.11
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.36
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide?
The IUPAC name of N-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide (CID 860463) is N-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide.
What is the SMILES notation for N-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide?
The canonical SMILES for N-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide is CCC(=O)Nc1ccc(S(=O)(=O)NCc2ccco2)cc1.
What is the InChIKey of N-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide?
The InChIKey is DFOKEQQPYHTMON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O4S/c1-2-14(17)16-11-5-7-13(8-6-11)21(18,19)15-10-12-4-3-9-20-12/h3-9,15H,2,10H2,1H3,(H,16,17).
What are the key properties of N-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide?
N-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide has a molecular weight of 308.36 g/mol, XLogP of 2.11, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide is sourced from PubChem (CID 860463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).