3-ethyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole

C8H11NO — CID 89233364

IUPAC3-ethyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole
SMILESCCc1onc2c1CCC2
InChIInChI=1S/C8H11NO/c1-2-8-6-4-3-5-7(6)9-10-8/h2-5H2,1H3
InChIKeyRAYYPUSOSGWMQN-UHFFFAOYSA-N
MW137.18 g/mol
LogP1.73
Rot. Bonds1

About 3-ethyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole

3-ethyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole (PubChem CID 89233364) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is 3-ethyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole.

Molecular Properties

Compound Name3-ethyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole
PubChem CID89233364
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name3-ethyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole
SMILESCCc1onc2c1CCC2
InChIInChI=1S/C8H11NO/c1-2-8-6-4-3-5-7(6)9-10-8/h2-5H2,1H3
InChIKeyRAYYPUSOSGWMQN-UHFFFAOYSA-N
XLogP1.73
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole?
The IUPAC name of 3-ethyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole (CID 89233364) is 3-ethyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole.
What is the SMILES notation for 3-ethyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole?
The canonical SMILES for 3-ethyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole is CCc1onc2c1CCC2.
What is the InChIKey of 3-ethyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole?
The InChIKey is RAYYPUSOSGWMQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO/c1-2-8-6-4-3-5-7(6)9-10-8/h2-5H2,1H3.
What are the key properties of 3-ethyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole?
3-ethyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole has a molecular weight of 137.18 g/mol, XLogP of 1.73, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole is sourced from PubChem (CID 89233364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).