3,5-dimethyl-N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,2-oxazole-4-sulfonamide

C15H16N4O3S — CID 110732544

IUPAC3,5-dimethyl-N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,2-oxazole-4-sulfonamide
SMILESCc1cc(-c2cccc(NS(=O)(=O)c3c(C)noc3C)c2)n[nH]1
InChIInChI=1S/C15H16N4O3S/c1-9-7-14(17-16-9)12-5-4-6-13(8-12)19-23(20,21)15-10(2)18-22-11(15)3/h4-8,19H,1-3H3,(H,16,17)
InChIKeyCUMLTTCXVDZCGM-UHFFFAOYSA-N
MW332.39 g/mol
LogP2.79
Rot. Bonds4

About 3,5-dimethyl-N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,2-oxazole-4-sulfonamide

3,5-dimethyl-N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,2-oxazole-4-sulfonamide (PubChem CID 110732544) has the molecular formula C15H16N4O3S and a molecular weight of 332.39 g/mol. Its IUPAC name is 3,5-dimethyl-N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,2-oxazole-4-sulfonamide.

Molecular Properties

Compound Name3,5-dimethyl-N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,2-oxazole-4-sulfonamide
PubChem CID110732544
Molecular FormulaC15H16N4O3S
Molecular Weight332.39 g/mol
Exact Mass332.09
IUPAC Name3,5-dimethyl-N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,2-oxazole-4-sulfonamide
SMILESCc1cc(-c2cccc(NS(=O)(=O)c3c(C)noc3C)c2)n[nH]1
InChIInChI=1S/C15H16N4O3S/c1-9-7-14(17-16-9)12-5-4-6-13(8-12)19-23(20,21)15-10(2)18-22-11(15)3/h4-8,19H,1-3H3,(H,16,17)
InChIKeyCUMLTTCXVDZCGM-UHFFFAOYSA-N
XLogP2.79
TPSA100.88 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.39
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3,5-dimethyl-N-(3-methylphenyl)-1,2-oxazole-4-sulfonamide
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N-(3-formylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
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N-(3-ethoxyphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
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3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-ethylbenzamide
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N-(1,3-dihydro-2-benzofuran-5-yl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
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N-[3-(2-aminoethoxy)phenyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 28755050
N-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
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3,5-dimethyl-N-(2-oxo-3H-1,3-benzoxazol-6-yl)-1,2-oxazole-4-sulfonamide
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2-methyl-N-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)furan-3-sulfonamide
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3,5-dimethyl-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1H-pyrazole-4-sulfonamide
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N-[4-(3-acetylanilino)phenyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,2-oxazole-4-sulfonamide?
The IUPAC name of 3,5-dimethyl-N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,2-oxazole-4-sulfonamide (CID 110732544) is 3,5-dimethyl-N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,2-oxazole-4-sulfonamide.
What is the SMILES notation for 3,5-dimethyl-N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,2-oxazole-4-sulfonamide?
The canonical SMILES for 3,5-dimethyl-N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,2-oxazole-4-sulfonamide is Cc1cc(-c2cccc(NS(=O)(=O)c3c(C)noc3C)c2)n[nH]1.
What is the InChIKey of 3,5-dimethyl-N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,2-oxazole-4-sulfonamide?
The InChIKey is CUMLTTCXVDZCGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O3S/c1-9-7-14(17-16-9)12-5-4-6-13(8-12)19-23(20,21)15-10(2)18-22-11(15)3/h4-8,19H,1-3H3,(H,16,17).
What are the key properties of 3,5-dimethyl-N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,2-oxazole-4-sulfonamide?
3,5-dimethyl-N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,2-oxazole-4-sulfonamide has a molecular weight of 332.39 g/mol, XLogP of 2.79, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]-1,2-oxazole-4-sulfonamide is sourced from PubChem (CID 110732544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).