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

C7H10N2O2 — CID 131223804

IUPAC1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutan-1-ol
SMILESCc1nc(C2(O)CCC2)no1
InChIInChI=1S/C7H10N2O2/c1-5-8-6(9-11-5)7(10)3-2-4-7/h10H,2-4H2,1H3
InChIKeyLHDQLPLMDMDQQB-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.75
Rot. Bonds1

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

1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutan-1-ol (PubChem CID 131223804) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutan-1-ol.

Molecular Properties

Compound Name1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutan-1-ol
PubChem CID131223804
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutan-1-ol
SMILESCc1nc(C2(O)CCC2)no1
InChIInChI=1S/C7H10N2O2/c1-5-8-6(9-11-5)7(10)3-2-4-7/h10H,2-4H2,1H3
InChIKeyLHDQLPLMDMDQQB-UHFFFAOYSA-N
XLogP0.75
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutan-1-ol?
The IUPAC name of 1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutan-1-ol (CID 131223804) is 1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutan-1-ol.
What is the SMILES notation for 1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutan-1-ol?
The canonical SMILES for 1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutan-1-ol is Cc1nc(C2(O)CCC2)no1.
What is the InChIKey of 1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutan-1-ol?
The InChIKey is LHDQLPLMDMDQQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-5-8-6(9-11-5)7(10)3-2-4-7/h10H,2-4H2,1H3.
What are the key properties of 1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutan-1-ol?
1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutan-1-ol has a molecular weight of 154.17 g/mol, XLogP of 0.75, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutan-1-ol is sourced from PubChem (CID 131223804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).