N-(1,2-oxazol-5-ylmethyl)-1H-imidazole-5-sulfonamide

C7H8N4O3S — CID 104600364

IUPACN-(1,2-oxazol-5-ylmethyl)-1H-imidazole-5-sulfonamide
SMILESO=S(=O)(NCc1ccno1)c1cnc[nH]1
InChIInChI=1S/C7H8N4O3S/c12-15(13,7-4-8-5-9-7)11-3-6-1-2-10-14-6/h1-2,4-5,11H,3H2,(H,8,9)
InChIKeyADZWHWVEPCIJAI-UHFFFAOYSA-N
MW228.23 g/mol
LogP-0.12
Rot. Bonds4

About N-(1,2-oxazol-5-ylmethyl)-1H-imidazole-5-sulfonamide

N-(1,2-oxazol-5-ylmethyl)-1H-imidazole-5-sulfonamide (PubChem CID 104600364) has the molecular formula C7H8N4O3S and a molecular weight of 228.23 g/mol. Its IUPAC name is N-(1,2-oxazol-5-ylmethyl)-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN-(1,2-oxazol-5-ylmethyl)-1H-imidazole-5-sulfonamide
PubChem CID104600364
Molecular FormulaC7H8N4O3S
Molecular Weight228.23 g/mol
Exact Mass228.03
IUPAC NameN-(1,2-oxazol-5-ylmethyl)-1H-imidazole-5-sulfonamide
SMILESO=S(=O)(NCc1ccno1)c1cnc[nH]1
InChIInChI=1S/C7H8N4O3S/c12-15(13,7-4-8-5-9-7)11-3-6-1-2-10-14-6/h1-2,4-5,11H,3H2,(H,8,9)
InChIKeyADZWHWVEPCIJAI-UHFFFAOYSA-N
XLogP-0.12
TPSA100.88 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.23
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1,3-thiazol-5-ylmethyl)-1H-imidazole-5-sulfonamide
CID 104600787
4-hydrazinyl-N-(1,2-oxazol-5-ylmethyl)pyridine-3-sulfonamide
CID 106419547
N-(1,2-oxazol-5-ylmethyl)ethanesulfonamide
CID 104600384
5-(1,2-oxazol-5-ylmethylsulfamoyl)-1H-pyrazole-4-carboxylic acid
CID 106415229
N-(quinolin-8-ylmethyl)-1H-imidazole-5-sulfonamide
CID 78996081
2-hydrazinyl-N-(1,2-oxazol-5-ylmethyl)pyridine-3-sulfonamide
CID 106419554
5-bromo-N-(1,2-oxazol-5-ylmethyl)thiophene-2-sulfonamide
CID 103940604
2-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridine-3-sulfonamide
CID 106422783
2-amino-6-fluoro-N-(1,2-oxazol-5-ylmethyl)benzenesulfonamide
CID 114185734
5-amino-2,4-difluoro-N-(1,2-oxazol-5-ylmethyl)benzenesulfonamide
CID 106413925
4-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)benzenesulfonamide
CID 106422766
N-[3-(methanesulfonamido)propyl]-1H-imidazole-5-sulfonamide
CID 103680413

Frequently Asked Questions

What is the IUPAC name of N-(1,2-oxazol-5-ylmethyl)-1H-imidazole-5-sulfonamide?
The IUPAC name of N-(1,2-oxazol-5-ylmethyl)-1H-imidazole-5-sulfonamide (CID 104600364) is N-(1,2-oxazol-5-ylmethyl)-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N-(1,2-oxazol-5-ylmethyl)-1H-imidazole-5-sulfonamide?
The canonical SMILES for N-(1,2-oxazol-5-ylmethyl)-1H-imidazole-5-sulfonamide is O=S(=O)(NCc1ccno1)c1cnc[nH]1.
What is the InChIKey of N-(1,2-oxazol-5-ylmethyl)-1H-imidazole-5-sulfonamide?
The InChIKey is ADZWHWVEPCIJAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4O3S/c12-15(13,7-4-8-5-9-7)11-3-6-1-2-10-14-6/h1-2,4-5,11H,3H2,(H,8,9).
What are the key properties of N-(1,2-oxazol-5-ylmethyl)-1H-imidazole-5-sulfonamide?
N-(1,2-oxazol-5-ylmethyl)-1H-imidazole-5-sulfonamide has a molecular weight of 228.23 g/mol, XLogP of -0.12, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-oxazol-5-ylmethyl)-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 104600364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).