1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-3-ol

C14H18N4O3 — CID 56769856

IUPAC1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-3-ol
SMILESCOCc1noc(-c2ccc(N3CCCC(O)C3)nc2)n1
InChIInChI=1S/C14H18N4O3/c1-20-9-12-16-14(21-17-12)10-4-5-13(15-7-10)18-6-2-3-11(19)8-18/h4-5,7,11,19H,2-3,6,8-9H2,1H3
InChIKeyPGRSRRHXJVMOPK-UHFFFAOYSA-N
MW290.32 g/mol
LogP1.24
Rot. Bonds4

About 1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-3-ol

1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-3-ol (PubChem CID 56769856) has the molecular formula C14H18N4O3 and a molecular weight of 290.32 g/mol. Its IUPAC name is 1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-3-ol.

Molecular Properties

Compound Name1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-3-ol
PubChem CID56769856
Molecular FormulaC14H18N4O3
Molecular Weight290.32 g/mol
Exact Mass290.14
IUPAC Name1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-3-ol
SMILESCOCc1noc(-c2ccc(N3CCCC(O)C3)nc2)n1
InChIInChI=1S/C14H18N4O3/c1-20-9-12-16-14(21-17-12)10-4-5-13(15-7-10)18-6-2-3-11(19)8-18/h4-5,7,11,19H,2-3,6,8-9H2,1H3
InChIKeyPGRSRRHXJVMOPK-UHFFFAOYSA-N
XLogP1.24
TPSA84.51 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-3-ol?
The IUPAC name of 1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-3-ol (CID 56769856) is 1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-3-ol.
What is the SMILES notation for 1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-3-ol?
The canonical SMILES for 1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-3-ol is COCc1noc(-c2ccc(N3CCCC(O)C3)nc2)n1.
What is the InChIKey of 1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-3-ol?
The InChIKey is PGRSRRHXJVMOPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O3/c1-20-9-12-16-14(21-17-12)10-4-5-13(15-7-10)18-6-2-3-11(19)8-18/h4-5,7,11,19H,2-3,6,8-9H2,1H3.
What are the key properties of 1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-3-ol?
1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-3-ol has a molecular weight of 290.32 g/mol, XLogP of 1.24, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-3-ol is sourced from PubChem (CID 56769856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).