1-methylimidazole;1,3-oxazole

C7H9N3O — CID 142355715

IUPAC1-methylimidazole;1,3-oxazole
SMILESCn1ccnc1.c1cocn1
InChIInChI=1S/C4H6N2.C3H3NO/c1-6-3-2-5-4-6;1-2-5-3-4-1/h2-4H,1H3;1-3H
InChIKeyYDNXDYUPRWHOAP-UHFFFAOYSA-N
MW151.17 g/mol
LogP1.09
Rot. Bonds

About 1-methylimidazole;1,3-oxazole

1-methylimidazole;1,3-oxazole (PubChem CID 142355715) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is 1-methylimidazole;1,3-oxazole.

Molecular Properties

Compound Name1-methylimidazole;1,3-oxazole
PubChem CID142355715
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC Name1-methylimidazole;1,3-oxazole
SMILESCn1ccnc1.c1cocn1
InChIInChI=1S/C4H6N2.C3H3NO/c1-6-3-2-5-4-6;1-2-5-3-4-1/h2-4H,1H3;1-3H
InChIKeyYDNXDYUPRWHOAP-UHFFFAOYSA-N
XLogP1.09
TPSA43.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methylimidazole;1,3-oxazole?
The IUPAC name of 1-methylimidazole;1,3-oxazole (CID 142355715) is 1-methylimidazole;1,3-oxazole.
What is the SMILES notation for 1-methylimidazole;1,3-oxazole?
The canonical SMILES for 1-methylimidazole;1,3-oxazole is Cn1ccnc1.c1cocn1.
What is the InChIKey of 1-methylimidazole;1,3-oxazole?
The InChIKey is YDNXDYUPRWHOAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2.C3H3NO/c1-6-3-2-5-4-6;1-2-5-3-4-1/h2-4H,1H3;1-3H.
What are the key properties of 1-methylimidazole;1,3-oxazole?
1-methylimidazole;1,3-oxazole has a molecular weight of 151.17 g/mol, XLogP of 1.09, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylimidazole;1,3-oxazole is sourced from PubChem (CID 142355715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).