3,4-dimethyl-5-pyridin-2-yl-1,2-oxazole

C10H10N2O — CID 71396997

IUPAC3,4-dimethyl-5-pyridin-2-yl-1,2-oxazole
SMILESCc1noc(-c2ccccn2)c1C
InChIInChI=1S/C10H10N2O/c1-7-8(2)12-13-10(7)9-5-3-4-6-11-9/h3-6H,1-2H3
InChIKeyNHLAMSKUPWIJEU-UHFFFAOYSA-N
MW174.20 g/mol
LogP2.35
Rot. Bonds1

About 3,4-dimethyl-5-pyridin-2-yl-1,2-oxazole

3,4-dimethyl-5-pyridin-2-yl-1,2-oxazole (PubChem CID 71396997) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 3,4-dimethyl-5-pyridin-2-yl-1,2-oxazole.

Molecular Properties

Compound Name3,4-dimethyl-5-pyridin-2-yl-1,2-oxazole
PubChem CID71396997
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name3,4-dimethyl-5-pyridin-2-yl-1,2-oxazole
SMILESCc1noc(-c2ccccn2)c1C
InChIInChI=1S/C10H10N2O/c1-7-8(2)12-13-10(7)9-5-3-4-6-11-9/h3-6H,1-2H3
InChIKeyNHLAMSKUPWIJEU-UHFFFAOYSA-N
XLogP2.35
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-5-pyridin-2-yl-1,2-oxazole?
The IUPAC name of 3,4-dimethyl-5-pyridin-2-yl-1,2-oxazole (CID 71396997) is 3,4-dimethyl-5-pyridin-2-yl-1,2-oxazole.
What is the SMILES notation for 3,4-dimethyl-5-pyridin-2-yl-1,2-oxazole?
The canonical SMILES for 3,4-dimethyl-5-pyridin-2-yl-1,2-oxazole is Cc1noc(-c2ccccn2)c1C.
What is the InChIKey of 3,4-dimethyl-5-pyridin-2-yl-1,2-oxazole?
The InChIKey is NHLAMSKUPWIJEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c1-7-8(2)12-13-10(7)9-5-3-4-6-11-9/h3-6H,1-2H3.
What are the key properties of 3,4-dimethyl-5-pyridin-2-yl-1,2-oxazole?
3,4-dimethyl-5-pyridin-2-yl-1,2-oxazole has a molecular weight of 174.20 g/mol, XLogP of 2.35, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-5-pyridin-2-yl-1,2-oxazole is sourced from PubChem (CID 71396997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).