4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole

C8H7N3O — CID 67416750

IUPAC4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole
SMILESC(=Cc1cnc[nH]1)c1cnoc1
InChIInChI=1S/C8H7N3O/c1(7-3-11-12-5-7)2-8-4-9-6-10-8/h1-6H,(H,9,10)
InChIKeySEPVYRQGNKMYTL-UHFFFAOYSA-N
MW161.16 g/mol
LogP1.57
Rot. Bonds2

About 4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole

4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole (PubChem CID 67416750) has the molecular formula C8H7N3O and a molecular weight of 161.16 g/mol. Its IUPAC name is 4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole.

Molecular Properties

Compound Name4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole
PubChem CID67416750
Molecular FormulaC8H7N3O
Molecular Weight161.16 g/mol
Exact Mass161.06
IUPAC Name4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole
SMILESC(=Cc1cnc[nH]1)c1cnoc1
InChIInChI=1S/C8H7N3O/c1(7-3-11-12-5-7)2-8-4-9-6-10-8/h1-6H,(H,9,10)
InChIKeySEPVYRQGNKMYTL-UHFFFAOYSA-N
XLogP1.57
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.16
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(E)-2-(1H-imidazol-5-yl)ethenyl]benzoic acid
CID 58256819
5-[(E)-2-(3-fluorophenyl)ethenyl]-1H-imidazole
CID 131237486
molecular hydrogen;5-[(E)-prop-1-enyl]-1H-imidazole
CID 143539521
4-[(E)-2-(1H-imidazol-5-yl)ethenyl]piperidine
CID 131238700
3-(1H-imidazol-5-yl)prop-2-enoic acid
CID 1178
3-(1H-imidazol-5-yl)prop-2-enoate
CID 5460648
(Z)-3-(1H-imidazol-5-yl)prop-2-en-1-imine
CID 139321163
4-[2-(1H-indazol-3-yl)ethenyl]-1,2-oxazole
CID 67417108
potassium 3-(1H-imidazol-5-yl)prop-2-enoate
CID 67892362
ethane;(E)-3-(1H-imidazol-5-yl)prop-2-enoic acid
CID 90887883
ethane;(E)-4-(1H-imidazol-5-yl)but-3-en-2-one
CID 91008820
3-(1H-imidazol-5-yl)-N-methylprop-2-enamide
CID 91343948

Frequently Asked Questions

What is the IUPAC name of 4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole?
The IUPAC name of 4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole (CID 67416750) is 4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole.
What is the SMILES notation for 4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole?
The canonical SMILES for 4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole is C(=Cc1cnc[nH]1)c1cnoc1.
What is the InChIKey of 4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole?
The InChIKey is SEPVYRQGNKMYTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3O/c1(7-3-11-12-5-7)2-8-4-9-6-10-8/h1-6H,(H,9,10).
What are the key properties of 4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole?
4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole has a molecular weight of 161.16 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1H-imidazol-5-yl)ethenyl]-1,2-oxazole is sourced from PubChem (CID 67416750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).