N-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide

C16H17N3O3S — CID 53372092

IUPACN-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
SMILESCc1ccccc1NS(=O)(=O)c1ccc(N2CCNC2=O)cc1
InChIInChI=1S/C16H17N3O3S/c1-12-4-2-3-5-15(12)18-23(21,22)14-8-6-13(7-9-14)19-11-10-17-16(19)20/h2-9,18H,10-11H2,1H3,(H,17,20)
InChIKeyKGFQYGFVTMWOBM-UHFFFAOYSA-N
MW331.40 g/mol
LogP2.33
Rot. Bonds4

About N-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide

N-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide (PubChem CID 53372092) has the molecular formula C16H17N3O3S and a molecular weight of 331.40 g/mol. Its IUPAC name is N-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
PubChem CID53372092
Molecular FormulaC16H17N3O3S
Molecular Weight331.40 g/mol
Exact Mass331.10
IUPAC NameN-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
SMILESCc1ccccc1NS(=O)(=O)c1ccc(N2CCNC2=O)cc1
InChIInChI=1S/C16H17N3O3S/c1-12-4-2-3-5-15(12)18-23(21,22)14-8-6-13(7-9-14)19-11-10-17-16(19)20/h2-9,18H,10-11H2,1H3,(H,17,20)
InChIKeyKGFQYGFVTMWOBM-UHFFFAOYSA-N
XLogP2.33
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.40
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide?
The IUPAC name of N-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide (CID 53372092) is N-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide.
What is the SMILES notation for N-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide?
The canonical SMILES for N-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide is Cc1ccccc1NS(=O)(=O)c1ccc(N2CCNC2=O)cc1.
What is the InChIKey of N-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide?
The InChIKey is KGFQYGFVTMWOBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3S/c1-12-4-2-3-5-15(12)18-23(21,22)14-8-6-13(7-9-14)19-11-10-17-16(19)20/h2-9,18H,10-11H2,1H3,(H,17,20).
What are the key properties of N-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide?
N-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide has a molecular weight of 331.40 g/mol, XLogP of 2.33, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide is sourced from PubChem (CID 53372092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).