1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol

C10H16N2O3 — CID 103096126

IUPAC1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol
SMILESCCC(O)c1noc(C2CCOCC2)n1
InChIInChI=1S/C10H16N2O3/c1-2-8(13)9-11-10(15-12-9)7-3-5-14-6-4-7/h7-8,13H,2-6H2,1H3
InChIKeyCSIIOOPHZXVEAE-UHFFFAOYSA-N
MW212.25 g/mol
LogP1.41
Rot. Bonds3

About 1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol

1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol (PubChem CID 103096126) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is 1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol.

Molecular Properties

Compound Name1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol
PubChem CID103096126
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC Name1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol
SMILESCCC(O)c1noc(C2CCOCC2)n1
InChIInChI=1S/C10H16N2O3/c1-2-8(13)9-11-10(15-12-9)7-3-5-14-6-4-7/h7-8,13H,2-6H2,1H3
InChIKeyCSIIOOPHZXVEAE-UHFFFAOYSA-N
XLogP1.41
TPSA68.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[5-(4,4-difluorocyclohexyl)-1,2,4-oxadiazol-3-yl]propan-1-ol
CID 103096109
3-(1-chloroethyl)-5-(oxan-4-yl)-1,2,4-oxadiazole
CID 102661013
1-(5-cyclooctyl-1,2,4-oxadiazol-3-yl)butan-1-ol
CID 104704309
2,2-dimethyl-1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine
CID 62905005
1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]butan-2-amine
CID 62905897
1-[5-(3,4-dihydro-2H-chromen-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol
CID 103096385
1-(5-cyclopentyl-1,2,4-oxadiazol-3-yl)propan-1-amine
CID 61326658
1-[5-(2-phenylcyclopropyl)-1,2,4-oxadiazol-3-yl]propan-1-ol
CID 103096443
1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-2-one
CID 115077121
3-(1-chloropropyl)-5-(4-methylcyclohexyl)-1,2,4-oxadiazole
CID 103095705
4-(3-butan-2-yl-1,2,4-oxadiazol-5-yl)-N-methylcyclohexan-1-amine
CID 63719470
1-[5-(2,3-dihydro-1,4-benzodioxin-3-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol
CID 103096202

Frequently Asked Questions

What is the IUPAC name of 1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol?
The IUPAC name of 1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol (CID 103096126) is 1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol.
What is the SMILES notation for 1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol?
The canonical SMILES for 1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol is CCC(O)c1noc(C2CCOCC2)n1.
What is the InChIKey of 1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol?
The InChIKey is CSIIOOPHZXVEAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c1-2-8(13)9-11-10(15-12-9)7-3-5-14-6-4-7/h7-8,13H,2-6H2,1H3.
What are the key properties of 1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol?
1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol has a molecular weight of 212.25 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol is sourced from PubChem (CID 103096126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).