3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-1,3-oxazolidine

C9H11N5O — CID 173336593

IUPAC3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-1,3-oxazolidine
SMILESc1cc(C2OCCN2c2ncc[nH]2)[nH]n1
InChIInChI=1S/C9H11N5O/c1-2-12-13-7(1)8-14(5-6-15-8)9-10-3-4-11-9/h1-4,8H,5-6H2,(H,10,11)(H,12,13)
InChIKeyXZPSKYRMISPLCI-UHFFFAOYSA-N
MW205.22 g/mol
LogP0.67
Rot. Bonds2

About 3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-1,3-oxazolidine

3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-1,3-oxazolidine (PubChem CID 173336593) has the molecular formula C9H11N5O and a molecular weight of 205.22 g/mol. Its IUPAC name is 3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-1,3-oxazolidine.

Molecular Properties

Compound Name3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-1,3-oxazolidine
PubChem CID173336593
Molecular FormulaC9H11N5O
Molecular Weight205.22 g/mol
Exact Mass205.10
IUPAC Name3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-1,3-oxazolidine
SMILESc1cc(C2OCCN2c2ncc[nH]2)[nH]n1
InChIInChI=1S/C9H11N5O/c1-2-12-13-7(1)8-14(5-6-15-8)9-10-3-4-11-9/h1-4,8H,5-6H2,(H,10,11)(H,12,13)
InChIKeyXZPSKYRMISPLCI-UHFFFAOYSA-N
XLogP0.67
TPSA69.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-1,3-oxazolidine?
The IUPAC name of 3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-1,3-oxazolidine (CID 173336593) is 3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-1,3-oxazolidine.
What is the SMILES notation for 3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-1,3-oxazolidine?
The canonical SMILES for 3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-1,3-oxazolidine is c1cc(C2OCCN2c2ncc[nH]2)[nH]n1.
What is the InChIKey of 3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-1,3-oxazolidine?
The InChIKey is XZPSKYRMISPLCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O/c1-2-12-13-7(1)8-14(5-6-15-8)9-10-3-4-11-9/h1-4,8H,5-6H2,(H,10,11)(H,12,13).
What are the key properties of 3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-1,3-oxazolidine?
3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-1,3-oxazolidine has a molecular weight of 205.22 g/mol, XLogP of 0.67, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-1,3-oxazolidine is sourced from PubChem (CID 173336593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).