5-cyclopropyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-oxazole-4-carboxamide

C15H17N3O4S — CID 74249264

IUPAC5-cyclopropyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-oxazole-4-carboxamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)c2ncoc2C2CC2)cc1
InChIInChI=1S/C15H17N3O4S/c16-23(20,21)12-5-1-10(2-6-12)7-8-17-15(19)13-14(11-3-4-11)22-9-18-13/h1-2,5-6,9,11H,3-4,7-8H2,(H,17,19)(H2,16,20,21)
InChIKeyDWVXBPMKLGCKAT-UHFFFAOYSA-N
MW335.39 g/mol
LogP1.17
Rot. Bonds6

About 5-cyclopropyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-oxazole-4-carboxamide

5-cyclopropyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-oxazole-4-carboxamide (PubChem CID 74249264) has the molecular formula C15H17N3O4S and a molecular weight of 335.39 g/mol. Its IUPAC name is 5-cyclopropyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-oxazole-4-carboxamide
PubChem CID74249264
Molecular FormulaC15H17N3O4S
Molecular Weight335.39 g/mol
Exact Mass335.09
IUPAC Name5-cyclopropyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-oxazole-4-carboxamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)c2ncoc2C2CC2)cc1
InChIInChI=1S/C15H17N3O4S/c16-23(20,21)12-5-1-10(2-6-12)7-8-17-15(19)13-14(11-3-4-11)22-9-18-13/h1-2,5-6,9,11H,3-4,7-8H2,(H,17,19)(H2,16,20,21)
InChIKeyDWVXBPMKLGCKAT-UHFFFAOYSA-N
XLogP1.17
TPSA115.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.39
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-oxazole-4-carboxamide?
The IUPAC name of 5-cyclopropyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-oxazole-4-carboxamide (CID 74249264) is 5-cyclopropyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-oxazole-4-carboxamide is NS(=O)(=O)c1ccc(CCNC(=O)c2ncoc2C2CC2)cc1.
What is the InChIKey of 5-cyclopropyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-oxazole-4-carboxamide?
The InChIKey is DWVXBPMKLGCKAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O4S/c16-23(20,21)12-5-1-10(2-6-12)7-8-17-15(19)13-14(11-3-4-11)22-9-18-13/h1-2,5-6,9,11H,3-4,7-8H2,(H,17,19)(H2,16,20,21).
What are the key properties of 5-cyclopropyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-oxazole-4-carboxamide?
5-cyclopropyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-oxazole-4-carboxamide has a molecular weight of 335.39 g/mol, XLogP of 1.17, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 74249264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).