4-ethyl-3,5-dipropyl-1,2-oxazole

C11H19NO — CID 44720140

IUPAC4-ethyl-3,5-dipropyl-1,2-oxazole
SMILESCCCc1noc(CCC)c1CC
InChIInChI=1S/C11H19NO/c1-4-7-10-9(6-3)11(8-5-2)13-12-10/h4-8H2,1-3H3
InChIKeySUFBLFFWZJBEME-UHFFFAOYSA-N
MW181.28 g/mol
LogP3.14
Rot. Bonds5

About 4-ethyl-3,5-dipropyl-1,2-oxazole

4-ethyl-3,5-dipropyl-1,2-oxazole (PubChem CID 44720140) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 4-ethyl-3,5-dipropyl-1,2-oxazole.

Molecular Properties

Compound Name4-ethyl-3,5-dipropyl-1,2-oxazole
PubChem CID44720140
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name4-ethyl-3,5-dipropyl-1,2-oxazole
SMILESCCCc1noc(CCC)c1CC
InChIInChI=1S/C11H19NO/c1-4-7-10-9(6-3)11(8-5-2)13-12-10/h4-8H2,1-3H3
InChIKeySUFBLFFWZJBEME-UHFFFAOYSA-N
XLogP3.14
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,4,5-Trimethylisoxazole
CID 25375
1-(3,5-Dimethyl-4-isoxazolyl)cyclododecanol
CID 3574794
3-Methyl-6,7-dihydro-1,2-benzisoxazol-4(5H)-one
CID 365021
3-Propyl-6,7-dihydro-5H-benzo[d]isoxazol-4-one oxime
CID 5407249
3-Cyclohexyl-4-methyl-1,2-oxazol-5-amine
CID 43158311
4-Isoxazolemethanamine, 3,5-diethyl-
CID 71755768
3-Methyl-5-(2,6,6-trimethyl-2-cyclohexen-1-yl)isoxazole
CID 3016056
Cyclooct[d]isoxazole, 4,5,8,9-tetrahydro-3-methyl-
CID 4393047
5-Ethyl-3-methyl-1,2-oxazole-4-carbaldehyde
CID 13181320
3-(Dimethyl-1,2-oxazol-4-yl)propan-1-amine
CID 16394817
4-(Chloromethyl)-3-ethyl-5-methyl-1,2-oxazole
CID 24973884
3-(3,5-Dimethylisoxazol-4-yl)propanoyl chloride
CID 50742546

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3,5-dipropyl-1,2-oxazole?
The IUPAC name of 4-ethyl-3,5-dipropyl-1,2-oxazole (CID 44720140) is 4-ethyl-3,5-dipropyl-1,2-oxazole.
What is the SMILES notation for 4-ethyl-3,5-dipropyl-1,2-oxazole?
The canonical SMILES for 4-ethyl-3,5-dipropyl-1,2-oxazole is CCCc1noc(CCC)c1CC.
What is the InChIKey of 4-ethyl-3,5-dipropyl-1,2-oxazole?
The InChIKey is SUFBLFFWZJBEME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c1-4-7-10-9(6-3)11(8-5-2)13-12-10/h4-8H2,1-3H3.
What are the key properties of 4-ethyl-3,5-dipropyl-1,2-oxazole?
4-ethyl-3,5-dipropyl-1,2-oxazole has a molecular weight of 181.28 g/mol, XLogP of 3.14, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3,5-dipropyl-1,2-oxazole is sourced from PubChem (CID 44720140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).