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

C14H15N3O4S — CID 74239201

IUPAC5-cyclopropyl-N-[(4-sulfamoylphenyl)methyl]-1,3-oxazole-4-carboxamide
SMILESNS(=O)(=O)c1ccc(CNC(=O)c2ncoc2C2CC2)cc1
InChIInChI=1S/C14H15N3O4S/c15-22(19,20)11-5-1-9(2-6-11)7-16-14(18)12-13(10-3-4-10)21-8-17-12/h1-2,5-6,8,10H,3-4,7H2,(H,16,18)(H2,15,19,20)
InChIKeyNRXLARKNBHBJKS-UHFFFAOYSA-N
MW321.36 g/mol
LogP1.13
Rot. Bonds5

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

5-cyclopropyl-N-[(4-sulfamoylphenyl)methyl]-1,3-oxazole-4-carboxamide (PubChem CID 74239201) has the molecular formula C14H15N3O4S and a molecular weight of 321.36 g/mol. Its IUPAC name is 5-cyclopropyl-N-[(4-sulfamoylphenyl)methyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-[(4-sulfamoylphenyl)methyl]-1,3-oxazole-4-carboxamide
PubChem CID74239201
Molecular FormulaC14H15N3O4S
Molecular Weight321.36 g/mol
Exact Mass321.08
IUPAC Name5-cyclopropyl-N-[(4-sulfamoylphenyl)methyl]-1,3-oxazole-4-carboxamide
SMILESNS(=O)(=O)c1ccc(CNC(=O)c2ncoc2C2CC2)cc1
InChIInChI=1S/C14H15N3O4S/c15-22(19,20)11-5-1-9(2-6-11)7-16-14(18)12-13(10-3-4-10)21-8-17-12/h1-2,5-6,8,10H,3-4,7H2,(H,16,18)(H2,15,19,20)
InChIKeyNRXLARKNBHBJKS-UHFFFAOYSA-N
XLogP1.13
TPSA115.29 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 ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(cyclopropylsulfamoyl)phenyl]-5-propan-2-yl-1,3-oxazole-4-carboxamide
CID 75463231
5-ethyl-N-[(2,3,4-trifluorophenyl)methyl]-1,3-oxazole-4-carboxamide
CID 28331197
N-(2,5-difluoro-4-methylphenyl)sulfonyl-5-propan-2-yl-1,3-oxazole-4-carboxamide
CID 71969403
N-(2,5-difluoro-4-methylphenyl)sulfonyl-5-ethyl-1,3-oxazole-4-carboxamide
CID 71969405
N-(2-fluoro-4-methylphenyl)sulfonyl-5-propan-2-yl-1,3-oxazole-4-carboxamide
CID 71985434
5-Cyclopropyl-N-{2-[3-(trifluoromethyl)phenyl]ethyl}-1,3-oxazole-4-carboxamide
CID 74247137
N-[3-[cyclopropyl-(3-fluorophenyl)sulfonylamino]propyl]-5-ethyl-1,3-oxazole-4-carboxamide
CID 75390496
5-pyrrolidin-2-yl-N-[4-[3-(trifluoromethyl)diazirin-3-yl]phenyl]sulfonyl-1,3-oxazole-4-carboxamide;2,2,2-trifluoroacetic acid
CID 167886483
5-pyrrolidin-2-yl-N-[4-[3-(trifluoromethyl)diazirin-3-yl]phenyl]sulfonyl-1,3-oxazole-4-carboxamide
CID 167886484
5-(3-fluorophenyl)-N-[(4-sulfamoylphenyl)methyl]-1,3-oxazole-4-carboxamide
CID 168036889
5-cyclopropyl-N-[1-(3-phenylpropyl)piperidin-3-yl]-1,3-oxazole-4-carboxamide
CID 45182054
N-{[5-Methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-YL]methyl}-4-(2-methylpropyl)benzene-1-sulfonamide
CID 53195440

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-[(4-sulfamoylphenyl)methyl]-1,3-oxazole-4-carboxamide?
The IUPAC name of 5-cyclopropyl-N-[(4-sulfamoylphenyl)methyl]-1,3-oxazole-4-carboxamide (CID 74239201) is 5-cyclopropyl-N-[(4-sulfamoylphenyl)methyl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-[(4-sulfamoylphenyl)methyl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-[(4-sulfamoylphenyl)methyl]-1,3-oxazole-4-carboxamide is NS(=O)(=O)c1ccc(CNC(=O)c2ncoc2C2CC2)cc1.
What is the InChIKey of 5-cyclopropyl-N-[(4-sulfamoylphenyl)methyl]-1,3-oxazole-4-carboxamide?
The InChIKey is NRXLARKNBHBJKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O4S/c15-22(19,20)11-5-1-9(2-6-11)7-16-14(18)12-13(10-3-4-10)21-8-17-12/h1-2,5-6,8,10H,3-4,7H2,(H,16,18)(H2,15,19,20).
What are the key properties of 5-cyclopropyl-N-[(4-sulfamoylphenyl)methyl]-1,3-oxazole-4-carboxamide?
5-cyclopropyl-N-[(4-sulfamoylphenyl)methyl]-1,3-oxazole-4-carboxamide has a molecular weight of 321.36 g/mol, XLogP of 1.13, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-[(4-sulfamoylphenyl)methyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 74239201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).