1H-imidazole;1,2-oxazole

C6H7N3O — CID 67377169

IUPAC1H-imidazole;1,2-oxazole
SMILESc1c[nH]cn1.c1cnoc1
InChIInChI=1S/C3H4N2.C3H3NO/c1-2-5-3-4-1;1-2-4-5-3-1/h1-3H,(H,4,5);1-3H
InChIKeyANSGTPXZQVRZOG-UHFFFAOYSA-N
MW137.14 g/mol
LogP1.08
Rot. Bonds

About 1H-imidazole;1,2-oxazole

1H-imidazole;1,2-oxazole (PubChem CID 67377169) has the molecular formula C6H7N3O and a molecular weight of 137.14 g/mol. Its IUPAC name is 1H-imidazole;1,2-oxazole.

Molecular Properties

Compound Name1H-imidazole;1,2-oxazole
PubChem CID67377169
Molecular FormulaC6H7N3O
Molecular Weight137.14 g/mol
Exact Mass137.06
IUPAC Name1H-imidazole;1,2-oxazole
SMILESc1c[nH]cn1.c1cnoc1
InChIInChI=1S/C3H4N2.C3H3NO/c1-2-5-3-4-1;1-2-4-5-3-1/h1-3H,(H,4,5);1-3H
InChIKeyANSGTPXZQVRZOG-UHFFFAOYSA-N
XLogP1.08
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.14
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1H-imidazole;1,2-oxazole?
The IUPAC name of 1H-imidazole;1,2-oxazole (CID 67377169) is 1H-imidazole;1,2-oxazole.
What is the SMILES notation for 1H-imidazole;1,2-oxazole?
The canonical SMILES for 1H-imidazole;1,2-oxazole is c1c[nH]cn1.c1cnoc1.
What is the InChIKey of 1H-imidazole;1,2-oxazole?
The InChIKey is ANSGTPXZQVRZOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4N2.C3H3NO/c1-2-5-3-4-1;1-2-4-5-3-1/h1-3H,(H,4,5);1-3H.
What are the key properties of 1H-imidazole;1,2-oxazole?
1H-imidazole;1,2-oxazole has a molecular weight of 137.14 g/mol, XLogP of 1.08, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-imidazole;1,2-oxazole is sourced from PubChem (CID 67377169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).