3-(6-ethyl-3-pyridinyl)-1,2-oxazole

C10H10N2O — CID 89020540

IUPAC3-(6-ethyl-3-pyridinyl)-1,2-oxazole
SMILESCCc1ccc(-c2ccon2)cn1
InChIInChI=1S/C10H10N2O/c1-2-9-4-3-8(7-11-9)10-5-6-13-12-10/h3-7H,2H2,1H3
InChIKeyYNRBQRNAFRVTTA-UHFFFAOYSA-N
MW174.20 g/mol
LogP2.30
Rot. Bonds2

About 3-(6-ethyl-3-pyridinyl)-1,2-oxazole

3-(6-ethyl-3-pyridinyl)-1,2-oxazole (PubChem CID 89020540) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 3-(6-ethyl-3-pyridinyl)-1,2-oxazole.

Molecular Properties

Compound Name3-(6-ethyl-3-pyridinyl)-1,2-oxazole
PubChem CID89020540
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name3-(6-ethyl-3-pyridinyl)-1,2-oxazole
SMILESCCc1ccc(-c2ccon2)cn1
InChIInChI=1S/C10H10N2O/c1-2-9-4-3-8(7-11-9)10-5-6-13-12-10/h3-7H,2H2,1H3
InChIKeyYNRBQRNAFRVTTA-UHFFFAOYSA-N
XLogP2.30
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(6-ethyl-3-pyridinyl)-1,2-oxazole?
The IUPAC name of 3-(6-ethyl-3-pyridinyl)-1,2-oxazole (CID 89020540) is 3-(6-ethyl-3-pyridinyl)-1,2-oxazole.
What is the SMILES notation for 3-(6-ethyl-3-pyridinyl)-1,2-oxazole?
The canonical SMILES for 3-(6-ethyl-3-pyridinyl)-1,2-oxazole is CCc1ccc(-c2ccon2)cn1.
What is the InChIKey of 3-(6-ethyl-3-pyridinyl)-1,2-oxazole?
The InChIKey is YNRBQRNAFRVTTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c1-2-9-4-3-8(7-11-9)10-5-6-13-12-10/h3-7H,2H2,1H3.
What are the key properties of 3-(6-ethyl-3-pyridinyl)-1,2-oxazole?
3-(6-ethyl-3-pyridinyl)-1,2-oxazole has a molecular weight of 174.20 g/mol, XLogP of 2.30, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-ethyl-3-pyridinyl)-1,2-oxazole is sourced from PubChem (CID 89020540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).