5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide

C8H10N2O4S — CID 154774184

IUPAC5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide
SMILESCS(=O)(=O)NC(=O)c1cc(C2CC2)on1
InChIInChI=1S/C8H10N2O4S/c1-15(12,13)10-8(11)6-4-7(14-9-6)5-2-3-5/h4-5H,2-3H2,1H3,(H,10,11)
InChIKeyLNEDLYVLLHRBIG-UHFFFAOYSA-N
MW230.24 g/mol
LogP0.24
Rot. Bonds3

About 5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide

5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide (PubChem CID 154774184) has the molecular formula C8H10N2O4S and a molecular weight of 230.24 g/mol. Its IUPAC name is 5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide
PubChem CID154774184
Molecular FormulaC8H10N2O4S
Molecular Weight230.24 g/mol
Exact Mass230.04
IUPAC Name5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide
SMILESCS(=O)(=O)NC(=O)c1cc(C2CC2)on1
InChIInChI=1S/C8H10N2O4S/c1-15(12,13)10-8(11)6-4-7(14-9-6)5-2-3-5/h4-5H,2-3H2,1H3,(H,10,11)
InChIKeyLNEDLYVLLHRBIG-UHFFFAOYSA-N
XLogP0.24
TPSA89.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.24
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

bis(5-cyclopropyl-1,2-oxazol-3-yl)methanone
CID 175316695
1-(5-cyclopropyl-1,2-oxazol-3-yl)ethanone;ethane
CID 178176268
N-butan-2-yl-5-cyclopropyl-1,2-oxazole-3-carboxamide
CID 6621450
5-cyclopropyl-N-(4,5-dimethyl-1H-pyrazol-3-yl)-1,2-oxazole-3-carboxamide
CID 112689333
5-cyclopropyl-N-[(3S,4S)-1,4-dimethylpyrrolidin-3-yl]-1,2-oxazole-3-carboxamide
CID 130395208
3-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]-2,2,3-trimethylbutanoic acid
CID 65261347
5-cyclopropyl-N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]-1,2-oxazole-3-carboxamide
CID 113434991
5-cyclopropyl-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-1,2-oxazole-3-carboxamide
CID 79252020
5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide
CID 60574068
(5-cyclopropyl-1,2-oxazol-3-yl)-(4-methylsulfonylpiperidin-1-yl)methanone
CID 71805699
2-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]butanoic acid
CID 43469491
5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide
CID 113236978

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide (CID 154774184) is 5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide is CS(=O)(=O)NC(=O)c1cc(C2CC2)on1.
What is the InChIKey of 5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide?
The InChIKey is LNEDLYVLLHRBIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O4S/c1-15(12,13)10-8(11)6-4-7(14-9-6)5-2-3-5/h4-5H,2-3H2,1H3,(H,10,11).
What are the key properties of 5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide?
5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide has a molecular weight of 230.24 g/mol, XLogP of 0.24, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 154774184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).