2-(2-methylimidazol-1-yl)-1,3-oxazole

C7H7N3O — CID 142655447

IUPAC2-(2-methylimidazol-1-yl)-1,3-oxazole
SMILESCc1nccn1-c1ncco1
InChIInChI=1S/C7H7N3O/c1-6-8-2-4-10(6)7-9-3-5-11-7/h2-5H,1H3
InChIKeyYLSQGXKPXRMCPH-UHFFFAOYSA-N
MW149.15 g/mol
LogP1.17
Rot. Bonds1

About 2-(2-methylimidazol-1-yl)-1,3-oxazole

2-(2-methylimidazol-1-yl)-1,3-oxazole (PubChem CID 142655447) has the molecular formula C7H7N3O and a molecular weight of 149.15 g/mol. Its IUPAC name is 2-(2-methylimidazol-1-yl)-1,3-oxazole.

Molecular Properties

Compound Name2-(2-methylimidazol-1-yl)-1,3-oxazole
PubChem CID142655447
Molecular FormulaC7H7N3O
Molecular Weight149.15 g/mol
Exact Mass149.06
IUPAC Name2-(2-methylimidazol-1-yl)-1,3-oxazole
SMILESCc1nccn1-c1ncco1
InChIInChI=1S/C7H7N3O/c1-6-8-2-4-10(6)7-9-3-5-11-7/h2-5H,1H3
InChIKeyYLSQGXKPXRMCPH-UHFFFAOYSA-N
XLogP1.17
TPSA43.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.15
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylimidazol-1-yl)-1,3-oxazole?
The IUPAC name of 2-(2-methylimidazol-1-yl)-1,3-oxazole (CID 142655447) is 2-(2-methylimidazol-1-yl)-1,3-oxazole.
What is the SMILES notation for 2-(2-methylimidazol-1-yl)-1,3-oxazole?
The canonical SMILES for 2-(2-methylimidazol-1-yl)-1,3-oxazole is Cc1nccn1-c1ncco1.
What is the InChIKey of 2-(2-methylimidazol-1-yl)-1,3-oxazole?
The InChIKey is YLSQGXKPXRMCPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O/c1-6-8-2-4-10(6)7-9-3-5-11-7/h2-5H,1H3.
What are the key properties of 2-(2-methylimidazol-1-yl)-1,3-oxazole?
2-(2-methylimidazol-1-yl)-1,3-oxazole has a molecular weight of 149.15 g/mol, XLogP of 1.17, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylimidazol-1-yl)-1,3-oxazole is sourced from PubChem (CID 142655447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).