2-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-imidazole-5-sulfonamide

C11H16N4O3S — CID 106389553

IUPAC2-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-imidazole-5-sulfonamide
SMILESCCc1ncc(S(=O)(=O)NC(C)c2ncc(C)o2)[nH]1
InChIInChI=1S/C11H16N4O3S/c1-4-9-12-6-10(14-9)19(16,17)15-8(3)11-13-5-7(2)18-11/h5-6,8,15H,4H2,1-3H3,(H,12,14)
InChIKeyWDOIOXUGZWURAO-UHFFFAOYSA-N
MW284.34 g/mol
LogP1.31
Rot. Bonds5

About 2-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-imidazole-5-sulfonamide

2-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-imidazole-5-sulfonamide (PubChem CID 106389553) has the molecular formula C11H16N4O3S and a molecular weight of 284.34 g/mol. Its IUPAC name is 2-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound Name2-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-imidazole-5-sulfonamide
PubChem CID106389553
Molecular FormulaC11H16N4O3S
Molecular Weight284.34 g/mol
Exact Mass284.09
IUPAC Name2-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-imidazole-5-sulfonamide
SMILESCCc1ncc(S(=O)(=O)NC(C)c2ncc(C)o2)[nH]1
InChIInChI=1S/C11H16N4O3S/c1-4-9-12-6-10(14-9)19(16,17)15-8(3)11-13-5-7(2)18-11/h5-6,8,15H,4H2,1-3H3,(H,12,14)
InChIKeyWDOIOXUGZWURAO-UHFFFAOYSA-N
XLogP1.31
TPSA100.88 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-imidazole-5-sulfonamide?
The IUPAC name of 2-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-imidazole-5-sulfonamide (CID 106389553) is 2-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-imidazole-5-sulfonamide.
What is the SMILES notation for 2-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-imidazole-5-sulfonamide?
The canonical SMILES for 2-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-imidazole-5-sulfonamide is CCc1ncc(S(=O)(=O)NC(C)c2ncc(C)o2)[nH]1.
What is the InChIKey of 2-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-imidazole-5-sulfonamide?
The InChIKey is WDOIOXUGZWURAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O3S/c1-4-9-12-6-10(14-9)19(16,17)15-8(3)11-13-5-7(2)18-11/h5-6,8,15H,4H2,1-3H3,(H,12,14).
What are the key properties of 2-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-imidazole-5-sulfonamide?
2-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-imidazole-5-sulfonamide has a molecular weight of 284.34 g/mol, XLogP of 1.31, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 106389553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).