1-(3-propyl-1,2,4-oxadiazol-5-yl)piperidin-4-ol

C10H17N3O2 — CID 58057758

IUPAC1-(3-propyl-1,2,4-oxadiazol-5-yl)piperidin-4-ol
SMILESCCCc1noc(N2CCC(O)CC2)n1
InChIInChI=1S/C10H17N3O2/c1-2-3-9-11-10(15-12-9)13-6-4-8(14)5-7-13/h8,14H,2-7H2,1H3
InChIKeyVDAVXUUFKHBPSV-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.98
Rot. Bonds3

About 1-(3-propyl-1,2,4-oxadiazol-5-yl)piperidin-4-ol

1-(3-propyl-1,2,4-oxadiazol-5-yl)piperidin-4-ol (PubChem CID 58057758) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 1-(3-propyl-1,2,4-oxadiazol-5-yl)piperidin-4-ol.

Molecular Properties

Compound Name1-(3-propyl-1,2,4-oxadiazol-5-yl)piperidin-4-ol
PubChem CID58057758
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name1-(3-propyl-1,2,4-oxadiazol-5-yl)piperidin-4-ol
SMILESCCCc1noc(N2CCC(O)CC2)n1
InChIInChI=1S/C10H17N3O2/c1-2-3-9-11-10(15-12-9)13-6-4-8(14)5-7-13/h8,14H,2-7H2,1H3
InChIKeyVDAVXUUFKHBPSV-UHFFFAOYSA-N
XLogP0.98
TPSA62.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(3-propyl-1,2,4-oxadiazol-5-yl)piperidin-4-ol?
The IUPAC name of 1-(3-propyl-1,2,4-oxadiazol-5-yl)piperidin-4-ol (CID 58057758) is 1-(3-propyl-1,2,4-oxadiazol-5-yl)piperidin-4-ol.
What is the SMILES notation for 1-(3-propyl-1,2,4-oxadiazol-5-yl)piperidin-4-ol?
The canonical SMILES for 1-(3-propyl-1,2,4-oxadiazol-5-yl)piperidin-4-ol is CCCc1noc(N2CCC(O)CC2)n1.
What is the InChIKey of 1-(3-propyl-1,2,4-oxadiazol-5-yl)piperidin-4-ol?
The InChIKey is VDAVXUUFKHBPSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-2-3-9-11-10(15-12-9)13-6-4-8(14)5-7-13/h8,14H,2-7H2,1H3.
What are the key properties of 1-(3-propyl-1,2,4-oxadiazol-5-yl)piperidin-4-ol?
1-(3-propyl-1,2,4-oxadiazol-5-yl)piperidin-4-ol has a molecular weight of 211.26 g/mol, XLogP of 0.98, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-propyl-1,2,4-oxadiazol-5-yl)piperidin-4-ol is sourced from PubChem (CID 58057758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).