N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide

C18H20N2O4S — CID 2963194

IUPACN-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1)c1ccccc1
InChIInChI=1S/C18H20N2O4S/c21-18(14-5-2-1-3-6-14)20-15-8-10-17(11-9-15)25(22,23)19-13-16-7-4-12-24-16/h1-3,5-6,8-11,16,19H,4,7,12-13H2,(H,20,21)
InChIKeyHHGORLDOGRMFEH-UHFFFAOYSA-N
MW360.44 g/mol
LogP2.40
Rot. Bonds6

About N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide

N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide (PubChem CID 2963194) has the molecular formula C18H20N2O4S and a molecular weight of 360.44 g/mol. Its IUPAC name is N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound NameN-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide
PubChem CID2963194
Molecular FormulaC18H20N2O4S
Molecular Weight360.44 g/mol
Exact Mass360.11
IUPAC NameN-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1)c1ccccc1
InChIInChI=1S/C18H20N2O4S/c21-18(14-5-2-1-3-6-14)20-15-8-10-17(11-9-15)25(22,23)19-13-16-7-4-12-24-16/h1-3,5-6,8-11,16,19H,4,7,12-13H2,(H,20,21)
InChIKeyHHGORLDOGRMFEH-UHFFFAOYSA-N
XLogP2.40
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.44
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide?
The IUPAC name of N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide (CID 2963194) is N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide?
The canonical SMILES for N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide is O=C(Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1)c1ccccc1.
What is the InChIKey of N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide?
The InChIKey is HHGORLDOGRMFEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O4S/c21-18(14-5-2-1-3-6-14)20-15-8-10-17(11-9-15)25(22,23)19-13-16-7-4-12-24-16/h1-3,5-6,8-11,16,19H,4,7,12-13H2,(H,20,21).
What are the key properties of N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide?
N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide has a molecular weight of 360.44 g/mol, XLogP of 2.40, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 2963194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).