2-cyclopentyl-1,3-oxazole

C8H11NO — CID 23591385

IUPAC2-cyclopentyl-1,3-oxazole
SMILESc1coc(C2CCCC2)n1
InChIInChI=1S/C8H11NO/c1-2-4-7(3-1)8-9-5-6-10-8/h5-7H,1-4H2
InChIKeyNTTLZXKSBZIKKY-UHFFFAOYSA-N
MW137.18 g/mol
LogP2.33
Rot. Bonds1

About 2-cyclopentyl-1,3-oxazole

2-cyclopentyl-1,3-oxazole (PubChem CID 23591385) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is 2-cyclopentyl-1,3-oxazole.

Molecular Properties

Compound Name2-cyclopentyl-1,3-oxazole
PubChem CID23591385
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name2-cyclopentyl-1,3-oxazole
SMILESc1coc(C2CCCC2)n1
InChIInChI=1S/C8H11NO/c1-2-4-7(3-1)8-9-5-6-10-8/h5-7H,1-4H2
InChIKeyNTTLZXKSBZIKKY-UHFFFAOYSA-N
XLogP2.33
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 ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1,3-oxazole?
The IUPAC name of 2-cyclopentyl-1,3-oxazole (CID 23591385) is 2-cyclopentyl-1,3-oxazole.
What is the SMILES notation for 2-cyclopentyl-1,3-oxazole?
The canonical SMILES for 2-cyclopentyl-1,3-oxazole is c1coc(C2CCCC2)n1.
What is the InChIKey of 2-cyclopentyl-1,3-oxazole?
The InChIKey is NTTLZXKSBZIKKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO/c1-2-4-7(3-1)8-9-5-6-10-8/h5-7H,1-4H2.
What are the key properties of 2-cyclopentyl-1,3-oxazole?
2-cyclopentyl-1,3-oxazole has a molecular weight of 137.18 g/mol, XLogP of 2.33, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1,3-oxazole is sourced from PubChem (CID 23591385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).