3-[(2-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)benzamide

C18H15FN2O4S — CID 984927

IUPAC3-[(2-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)benzamide
SMILESO=C(NCc1ccco1)c1cccc(NS(=O)(=O)c2ccccc2F)c1
InChIInChI=1S/C18H15FN2O4S/c19-16-8-1-2-9-17(16)26(23,24)21-14-6-3-5-13(11-14)18(22)20-12-15-7-4-10-25-15/h1-11,21H,12H2,(H,20,22)
InChIKeyKJKRKHFQARXSKB-UHFFFAOYSA-N
MW374.39 g/mol
LogP3.15
Rot. Bonds6

About 3-[(2-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)benzamide

3-[(2-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)benzamide (PubChem CID 984927) has the molecular formula C18H15FN2O4S and a molecular weight of 374.39 g/mol. Its IUPAC name is 3-[(2-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name3-[(2-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)benzamide
PubChem CID984927
Molecular FormulaC18H15FN2O4S
Molecular Weight374.39 g/mol
Exact Mass374.07
IUPAC Name3-[(2-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)benzamide
SMILESO=C(NCc1ccco1)c1cccc(NS(=O)(=O)c2ccccc2F)c1
InChIInChI=1S/C18H15FN2O4S/c19-16-8-1-2-9-17(16)26(23,24)21-14-6-3-5-13(11-14)18(22)20-12-15-7-4-10-25-15/h1-11,21H,12H2,(H,20,22)
InChIKeyKJKRKHFQARXSKB-UHFFFAOYSA-N
XLogP3.15
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.39
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(2-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)benzamide?
The IUPAC name of 3-[(2-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)benzamide (CID 984927) is 3-[(2-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)benzamide.
What is the SMILES notation for 3-[(2-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)benzamide?
The canonical SMILES for 3-[(2-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)benzamide is O=C(NCc1ccco1)c1cccc(NS(=O)(=O)c2ccccc2F)c1.
What is the InChIKey of 3-[(2-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)benzamide?
The InChIKey is KJKRKHFQARXSKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O4S/c19-16-8-1-2-9-17(16)26(23,24)21-14-6-3-5-13(11-14)18(22)20-12-15-7-4-10-25-15/h1-11,21H,12H2,(H,20,22).
What are the key properties of 3-[(2-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)benzamide?
3-[(2-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)benzamide has a molecular weight of 374.39 g/mol, XLogP of 3.15, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)benzamide is sourced from PubChem (CID 984927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).