2,4-diethyl-5-propyl-1,3-oxazole

C10H17NO — CID 86003227

IUPAC2,4-diethyl-5-propyl-1,3-oxazole
SMILESCCCc1oc(CC)nc1CC
InChIInChI=1S/C10H17NO/c1-4-7-9-8(5-2)11-10(6-3)12-9/h4-7H2,1-3H3
InChIKeyNEZWJGLSYGBROR-UHFFFAOYSA-N
MW167.25 g/mol
LogP2.75
Rot. Bonds4

About 2,4-diethyl-5-propyl-1,3-oxazole

2,4-diethyl-5-propyl-1,3-oxazole (PubChem CID 86003227) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 2,4-diethyl-5-propyl-1,3-oxazole.

Molecular Properties

Compound Name2,4-diethyl-5-propyl-1,3-oxazole
PubChem CID86003227
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name2,4-diethyl-5-propyl-1,3-oxazole
SMILESCCCc1oc(CC)nc1CC
InChIInChI=1S/C10H17NO/c1-4-7-9-8(5-2)11-10(6-3)12-9/h4-7H2,1-3H3
InChIKeyNEZWJGLSYGBROR-UHFFFAOYSA-N
XLogP2.75
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-diethyl-5-propyl-1,3-oxazole?
The IUPAC name of 2,4-diethyl-5-propyl-1,3-oxazole (CID 86003227) is 2,4-diethyl-5-propyl-1,3-oxazole.
What is the SMILES notation for 2,4-diethyl-5-propyl-1,3-oxazole?
The canonical SMILES for 2,4-diethyl-5-propyl-1,3-oxazole is CCCc1oc(CC)nc1CC.
What is the InChIKey of 2,4-diethyl-5-propyl-1,3-oxazole?
The InChIKey is NEZWJGLSYGBROR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-4-7-9-8(5-2)11-10(6-3)12-9/h4-7H2,1-3H3.
What are the key properties of 2,4-diethyl-5-propyl-1,3-oxazole?
2,4-diethyl-5-propyl-1,3-oxazole has a molecular weight of 167.25 g/mol, XLogP of 2.75, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diethyl-5-propyl-1,3-oxazole is sourced from PubChem (CID 86003227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).