2-ethyl-4-methyl-5-propyl-1,3-oxazole

C9H15NO — CID 525780

IUPAC2-ethyl-4-methyl-5-propyl-1,3-oxazole
SMILESCCCc1oc(CC)nc1C
InChIInChI=1S/C9H15NO/c1-4-6-8-7(3)10-9(5-2)11-8/h4-6H2,1-3H3
InChIKeyFDMDJAGBUGUESB-UHFFFAOYSA-N
MW153.22 g/mol
LogP2.50
Rot. Bonds3

About 2-ethyl-4-methyl-5-propyl-1,3-oxazole

2-ethyl-4-methyl-5-propyl-1,3-oxazole (PubChem CID 525780) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is 2-ethyl-4-methyl-5-propyl-1,3-oxazole.

Molecular Properties

Compound Name2-ethyl-4-methyl-5-propyl-1,3-oxazole
PubChem CID525780
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name2-ethyl-4-methyl-5-propyl-1,3-oxazole
SMILESCCCc1oc(CC)nc1C
InChIInChI=1S/C9H15NO/c1-4-6-8-7(3)10-9(5-2)11-8/h4-6H2,1-3H3
InChIKeyFDMDJAGBUGUESB-UHFFFAOYSA-N
XLogP2.50
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-Ethyl-2,5-dimethyloxazole
CID 121694
4,5-Dimethyl-2-propyloxazole
CID 104620
2-Butyl-4,5-dimethyloxazole
CID 522807
4-Butyl-2,5-dimethyloxazole
CID 525777
2-Butyl-5-ethyl-4-methyl-1,3-oxazole
CID 580388
5-Butyl-4-ethyl-2-methyl-1,3-oxazole
CID 71414755
2,4-Dimethyl-5-propyloxazole
CID 525774
2-Butyl-4,5-diethyloxazole
CID 525778
2-Butyl-5-methyl-4-propyloxazole
CID 525779
5-Ethyl-2-hexyl-4-methyloxazole
CID 525782
2-Butyl-4-ethyl-5-methyl-1,3-oxazole
CID 580707
4-Ethyl-5-methyl-2-(1-methylethyl)oxazole
CID 586689

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-methyl-5-propyl-1,3-oxazole?
The IUPAC name of 2-ethyl-4-methyl-5-propyl-1,3-oxazole (CID 525780) is 2-ethyl-4-methyl-5-propyl-1,3-oxazole.
What is the SMILES notation for 2-ethyl-4-methyl-5-propyl-1,3-oxazole?
The canonical SMILES for 2-ethyl-4-methyl-5-propyl-1,3-oxazole is CCCc1oc(CC)nc1C.
What is the InChIKey of 2-ethyl-4-methyl-5-propyl-1,3-oxazole?
The InChIKey is FDMDJAGBUGUESB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-4-6-8-7(3)10-9(5-2)11-8/h4-6H2,1-3H3.
What are the key properties of 2-ethyl-4-methyl-5-propyl-1,3-oxazole?
2-ethyl-4-methyl-5-propyl-1,3-oxazole has a molecular weight of 153.22 g/mol, XLogP of 2.50, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-methyl-5-propyl-1,3-oxazole is sourced from PubChem (CID 525780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).