5-(piperidin-4-ylmethoxymethyl)-1,2-oxazole

C10H16N2O2 — CID 62338871

IUPAC5-(piperidin-4-ylmethoxymethyl)-1,2-oxazole
SMILESc1cc(COCC2CCNCC2)on1
InChIInChI=1S/C10H16N2O2/c1-4-11-5-2-9(1)7-13-8-10-3-6-12-14-10/h3,6,9,11H,1-2,4-5,7-8H2
InChIKeyKVEWRHBFXXWDOM-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.19
Rot. Bonds4

About 5-(piperidin-4-ylmethoxymethyl)-1,2-oxazole

5-(piperidin-4-ylmethoxymethyl)-1,2-oxazole (PubChem CID 62338871) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 5-(piperidin-4-ylmethoxymethyl)-1,2-oxazole.

Molecular Properties

Compound Name5-(piperidin-4-ylmethoxymethyl)-1,2-oxazole
PubChem CID62338871
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name5-(piperidin-4-ylmethoxymethyl)-1,2-oxazole
SMILESc1cc(COCC2CCNCC2)on1
InChIInChI=1S/C10H16N2O2/c1-4-11-5-2-9(1)7-13-8-10-3-6-12-14-10/h3,6,9,11H,1-2,4-5,7-8H2
InChIKeyKVEWRHBFXXWDOM-UHFFFAOYSA-N
XLogP1.19
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(piperidin-4-ylmethoxymethyl)-1,2-oxazole?
The IUPAC name of 5-(piperidin-4-ylmethoxymethyl)-1,2-oxazole (CID 62338871) is 5-(piperidin-4-ylmethoxymethyl)-1,2-oxazole.
What is the SMILES notation for 5-(piperidin-4-ylmethoxymethyl)-1,2-oxazole?
The canonical SMILES for 5-(piperidin-4-ylmethoxymethyl)-1,2-oxazole is c1cc(COCC2CCNCC2)on1.
What is the InChIKey of 5-(piperidin-4-ylmethoxymethyl)-1,2-oxazole?
The InChIKey is KVEWRHBFXXWDOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-4-11-5-2-9(1)7-13-8-10-3-6-12-14-10/h3,6,9,11H,1-2,4-5,7-8H2.
What are the key properties of 5-(piperidin-4-ylmethoxymethyl)-1,2-oxazole?
5-(piperidin-4-ylmethoxymethyl)-1,2-oxazole has a molecular weight of 196.25 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(piperidin-4-ylmethoxymethyl)-1,2-oxazole is sourced from PubChem (CID 62338871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).