N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide

C11H16N4O3S — CID 60958534

IUPACN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide
SMILESCc1noc(C)c1CN(C)S(=O)(=O)c1cn[nH]c1C
InChIInChI=1S/C11H16N4O3S/c1-7-10(9(3)18-14-7)6-15(4)19(16,17)11-5-12-13-8(11)2/h5H,6H2,1-4H3,(H,12,13)
InChIKeyFZSRJLYOTOPNOP-UHFFFAOYSA-N
MW284.34 g/mol
LogP1.14
Rot. Bonds4

About N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide

N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide (PubChem CID 60958534) has the molecular formula C11H16N4O3S and a molecular weight of 284.34 g/mol. Its IUPAC name is N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide
PubChem CID60958534
Molecular FormulaC11H16N4O3S
Molecular Weight284.34 g/mol
Exact Mass284.09
IUPAC NameN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide
SMILESCc1noc(C)c1CN(C)S(=O)(=O)c1cn[nH]c1C
InChIInChI=1S/C11H16N4O3S/c1-7-10(9(3)18-14-7)6-15(4)19(16,17)11-5-12-13-8(11)2/h5H,6H2,1-4H3,(H,12,13)
InChIKeyFZSRJLYOTOPNOP-UHFFFAOYSA-N
XLogP1.14
TPSA92.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide (CID 60958534) is N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide is Cc1noc(C)c1CN(C)S(=O)(=O)c1cn[nH]c1C.
What is the InChIKey of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide?
The InChIKey is FZSRJLYOTOPNOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O3S/c1-7-10(9(3)18-14-7)6-15(4)19(16,17)11-5-12-13-8(11)2/h5H,6H2,1-4H3,(H,12,13).
What are the key properties of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide?
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide has a molecular weight of 284.34 g/mol, XLogP of 1.14, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,5-dimethyl-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 60958534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).