N-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide

C14H15N3O4S — CID 109058391

IUPACN-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide
SMILESCc1cc(NS(=O)(=O)c2ccc(C(=O)NC3CC3)cc2)no1
InChIInChI=1S/C14H15N3O4S/c1-9-8-13(16-21-9)17-22(19,20)12-6-2-10(3-7-12)14(18)15-11-4-5-11/h2-3,6-8,11H,4-5H2,1H3,(H,15,18)(H,16,17)
InChIKeyQCIKCZZKTJASPO-UHFFFAOYSA-N
MW321.36 g/mol
LogP1.68
Rot. Bonds5

About N-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide

N-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide (PubChem CID 109058391) has the molecular formula C14H15N3O4S and a molecular weight of 321.36 g/mol. Its IUPAC name is N-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide
PubChem CID109058391
Molecular FormulaC14H15N3O4S
Molecular Weight321.36 g/mol
Exact Mass321.08
IUPAC NameN-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide
SMILESCc1cc(NS(=O)(=O)c2ccc(C(=O)NC3CC3)cc2)no1
InChIInChI=1S/C14H15N3O4S/c1-9-8-13(16-21-9)17-22(19,20)12-6-2-10(3-7-12)14(18)15-11-4-5-11/h2-3,6-8,11H,4-5H2,1H3,(H,15,18)(H,16,17)
InChIKeyQCIKCZZKTJASPO-UHFFFAOYSA-N
XLogP1.68
TPSA101.30 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.36
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]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-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide?
The IUPAC name of N-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide (CID 109058391) is N-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide.
What is the SMILES notation for N-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide?
The canonical SMILES for N-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide is Cc1cc(NS(=O)(=O)c2ccc(C(=O)NC3CC3)cc2)no1.
What is the InChIKey of N-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide?
The InChIKey is QCIKCZZKTJASPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O4S/c1-9-8-13(16-21-9)17-22(19,20)12-6-2-10(3-7-12)14(18)15-11-4-5-11/h2-3,6-8,11H,4-5H2,1H3,(H,15,18)(H,16,17).
What are the key properties of N-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide?
N-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide has a molecular weight of 321.36 g/mol, XLogP of 1.68, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide is sourced from PubChem (CID 109058391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).