1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-ol

C8H12N2O2 — CID 130742055

IUPAC1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-ol
SMILESCc1noc(C2(O)CCCC2)n1
InChIInChI=1S/C8H12N2O2/c1-6-9-7(12-10-6)8(11)4-2-3-5-8/h11H,2-5H2,1H3
InChIKeyZBCHFTZNHVFRGH-UHFFFAOYSA-N
MW168.20 g/mol
LogP1.14
Rot. Bonds1

About 1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-ol

1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-ol (PubChem CID 130742055) has the molecular formula C8H12N2O2 and a molecular weight of 168.20 g/mol. Its IUPAC name is 1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-ol.

Molecular Properties

Compound Name1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-ol
PubChem CID130742055
Molecular FormulaC8H12N2O2
Molecular Weight168.20 g/mol
Exact Mass168.09
IUPAC Name1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-ol
SMILESCc1noc(C2(O)CCCC2)n1
InChIInChI=1S/C8H12N2O2/c1-6-9-7(12-10-6)8(11)4-2-3-5-8/h11H,2-5H2,1H3
InChIKeyZBCHFTZNHVFRGH-UHFFFAOYSA-N
XLogP1.14
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-ol?
The IUPAC name of 1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-ol (CID 130742055) is 1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-ol.
What is the SMILES notation for 1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-ol?
The canonical SMILES for 1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-ol is Cc1noc(C2(O)CCCC2)n1.
What is the InChIKey of 1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-ol?
The InChIKey is ZBCHFTZNHVFRGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2/c1-6-9-7(12-10-6)8(11)4-2-3-5-8/h11H,2-5H2,1H3.
What are the key properties of 1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-ol?
1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-ol has a molecular weight of 168.20 g/mol, XLogP of 1.14, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-ol is sourced from PubChem (CID 130742055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).