2-(cyclopenten-1-yl)-5-ethyl-1,3,4-oxadiazole

C9H12N2O — CID 130622005

IUPAC2-(cyclopenten-1-yl)-5-ethyl-1,3,4-oxadiazole
SMILESCCc1nnc(C2=CCCC2)o1
InChIInChI=1S/C9H12N2O/c1-2-8-10-11-9(12-8)7-5-3-4-6-7/h5H,2-4,6H2,1H3
InChIKeyOEGYMNJWWXJUOO-UHFFFAOYSA-N
MW164.21 g/mol
LogP2.20
Rot. Bonds2

About 2-(cyclopenten-1-yl)-5-ethyl-1,3,4-oxadiazole

2-(cyclopenten-1-yl)-5-ethyl-1,3,4-oxadiazole (PubChem CID 130622005) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 2-(cyclopenten-1-yl)-5-ethyl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(cyclopenten-1-yl)-5-ethyl-1,3,4-oxadiazole
PubChem CID130622005
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name2-(cyclopenten-1-yl)-5-ethyl-1,3,4-oxadiazole
SMILESCCc1nnc(C2=CCCC2)o1
InChIInChI=1S/C9H12N2O/c1-2-8-10-11-9(12-8)7-5-3-4-6-7/h5H,2-4,6H2,1H3
InChIKeyOEGYMNJWWXJUOO-UHFFFAOYSA-N
XLogP2.20
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopenten-1-yl)-5-ethyl-1,3,4-oxadiazole?
The IUPAC name of 2-(cyclopenten-1-yl)-5-ethyl-1,3,4-oxadiazole (CID 130622005) is 2-(cyclopenten-1-yl)-5-ethyl-1,3,4-oxadiazole.
What is the SMILES notation for 2-(cyclopenten-1-yl)-5-ethyl-1,3,4-oxadiazole?
The canonical SMILES for 2-(cyclopenten-1-yl)-5-ethyl-1,3,4-oxadiazole is CCc1nnc(C2=CCCC2)o1.
What is the InChIKey of 2-(cyclopenten-1-yl)-5-ethyl-1,3,4-oxadiazole?
The InChIKey is OEGYMNJWWXJUOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c1-2-8-10-11-9(12-8)7-5-3-4-6-7/h5H,2-4,6H2,1H3.
What are the key properties of 2-(cyclopenten-1-yl)-5-ethyl-1,3,4-oxadiazole?
2-(cyclopenten-1-yl)-5-ethyl-1,3,4-oxadiazole has a molecular weight of 164.21 g/mol, XLogP of 2.20, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopenten-1-yl)-5-ethyl-1,3,4-oxadiazole is sourced from PubChem (CID 130622005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).