4-ethyl-5-methyl-2-(2-methylpropyl)-1,3-oxazole

C10H17NO — CID 580607

IUPAC4-ethyl-5-methyl-2-(2-methylpropyl)-1,3-oxazole
SMILESCCc1nc(CC(C)C)oc1C
InChIInChI=1S/C10H17NO/c1-5-9-8(4)12-10(11-9)6-7(2)3/h7H,5-6H2,1-4H3
InChIKeyKGIIOPAYOWPZLL-UHFFFAOYSA-N
MW167.25 g/mol
LogP2.74
Rot. Bonds3

About 4-ethyl-5-methyl-2-(2-methylpropyl)-1,3-oxazole

4-ethyl-5-methyl-2-(2-methylpropyl)-1,3-oxazole (PubChem CID 580607) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 4-ethyl-5-methyl-2-(2-methylpropyl)-1,3-oxazole.

Molecular Properties

Compound Name4-ethyl-5-methyl-2-(2-methylpropyl)-1,3-oxazole
PubChem CID580607
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name4-ethyl-5-methyl-2-(2-methylpropyl)-1,3-oxazole
SMILESCCc1nc(CC(C)C)oc1C
InChIInChI=1S/C10H17NO/c1-5-9-8(4)12-10(11-9)6-7(2)3/h7H,5-6H2,1-4H3
InChIKeyKGIIOPAYOWPZLL-UHFFFAOYSA-N
XLogP2.74
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-methyl-2-(2-methylpropyl)-1,3-oxazole?
The IUPAC name of 4-ethyl-5-methyl-2-(2-methylpropyl)-1,3-oxazole (CID 580607) is 4-ethyl-5-methyl-2-(2-methylpropyl)-1,3-oxazole.
What is the SMILES notation for 4-ethyl-5-methyl-2-(2-methylpropyl)-1,3-oxazole?
The canonical SMILES for 4-ethyl-5-methyl-2-(2-methylpropyl)-1,3-oxazole is CCc1nc(CC(C)C)oc1C.
What is the InChIKey of 4-ethyl-5-methyl-2-(2-methylpropyl)-1,3-oxazole?
The InChIKey is KGIIOPAYOWPZLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-5-9-8(4)12-10(11-9)6-7(2)3/h7H,5-6H2,1-4H3.
What are the key properties of 4-ethyl-5-methyl-2-(2-methylpropyl)-1,3-oxazole?
4-ethyl-5-methyl-2-(2-methylpropyl)-1,3-oxazole has a molecular weight of 167.25 g/mol, XLogP of 2.74, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-methyl-2-(2-methylpropyl)-1,3-oxazole is sourced from PubChem (CID 580607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).