N-(furan-2-ylmethyl)-4-(methanesulfonamido)benzamide

C13H14N2O4S — CID 1251695

IUPACN-(furan-2-ylmethyl)-4-(methanesulfonamido)benzamide
SMILESCS(=O)(=O)Nc1ccc(C(=O)NCc2ccco2)cc1
InChIInChI=1S/C13H14N2O4S/c1-20(17,18)15-11-6-4-10(5-7-11)13(16)14-9-12-3-2-8-19-12/h2-8,15H,9H2,1H3,(H,14,16)
InChIKeyQUZCLDDLFMLRPR-UHFFFAOYSA-N
MW294.33 g/mol
LogP1.58
Rot. Bonds5

About N-(furan-2-ylmethyl)-4-(methanesulfonamido)benzamide

N-(furan-2-ylmethyl)-4-(methanesulfonamido)benzamide (PubChem CID 1251695) has the molecular formula C13H14N2O4S and a molecular weight of 294.33 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-4-(methanesulfonamido)benzamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-4-(methanesulfonamido)benzamide
PubChem CID1251695
Molecular FormulaC13H14N2O4S
Molecular Weight294.33 g/mol
Exact Mass294.07
IUPAC NameN-(furan-2-ylmethyl)-4-(methanesulfonamido)benzamide
SMILESCS(=O)(=O)Nc1ccc(C(=O)NCc2ccco2)cc1
InChIInChI=1S/C13H14N2O4S/c1-20(17,18)15-11-6-4-10(5-7-11)13(16)14-9-12-3-2-8-19-12/h2-8,15H,9H2,1H3,(H,14,16)
InChIKeyQUZCLDDLFMLRPR-UHFFFAOYSA-N
XLogP1.58
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-4-(methanesulfonamido)benzamide?
The IUPAC name of N-(furan-2-ylmethyl)-4-(methanesulfonamido)benzamide (CID 1251695) is N-(furan-2-ylmethyl)-4-(methanesulfonamido)benzamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-4-(methanesulfonamido)benzamide?
The canonical SMILES for N-(furan-2-ylmethyl)-4-(methanesulfonamido)benzamide is CS(=O)(=O)Nc1ccc(C(=O)NCc2ccco2)cc1.
What is the InChIKey of N-(furan-2-ylmethyl)-4-(methanesulfonamido)benzamide?
The InChIKey is QUZCLDDLFMLRPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O4S/c1-20(17,18)15-11-6-4-10(5-7-11)13(16)14-9-12-3-2-8-19-12/h2-8,15H,9H2,1H3,(H,14,16).
What are the key properties of N-(furan-2-ylmethyl)-4-(methanesulfonamido)benzamide?
N-(furan-2-ylmethyl)-4-(methanesulfonamido)benzamide has a molecular weight of 294.33 g/mol, XLogP of 1.58, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-4-(methanesulfonamido)benzamide is sourced from PubChem (CID 1251695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).