5-methyl-3-(2-piperidin-1-ylethyl)-1,2-oxazole

C11H18N2O — CID 13688

IUPAC5-methyl-3-(2-piperidin-1-ylethyl)-1,2-oxazole
SMILESCc1cc(CCN2CCCCC2)no1
InChIInChI=1S/C11H18N2O/c1-10-9-11(12-14-10)5-8-13-6-3-2-4-7-13/h9H,2-8H2,1H3
InChIKeyWAFHMWXIPPOZKR-UHFFFAOYSA-N
MW194.28 g/mol
LogP2.01
Rot. Bonds3

About 5-methyl-3-(2-piperidin-1-ylethyl)-1,2-oxazole

5-methyl-3-(2-piperidin-1-ylethyl)-1,2-oxazole (PubChem CID 13688) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 5-methyl-3-(2-piperidin-1-ylethyl)-1,2-oxazole.

Molecular Properties

Compound Name5-methyl-3-(2-piperidin-1-ylethyl)-1,2-oxazole
PubChem CID13688
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name5-methyl-3-(2-piperidin-1-ylethyl)-1,2-oxazole
SMILESCc1cc(CCN2CCCCC2)no1
InChIInChI=1S/C11H18N2O/c1-10-9-11(12-14-10)5-8-13-6-3-2-4-7-13/h9H,2-8H2,1H3
InChIKeyWAFHMWXIPPOZKR-UHFFFAOYSA-N
XLogP2.01
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-(2-piperidin-1-ylethyl)-1,2-oxazole?
The IUPAC name of 5-methyl-3-(2-piperidin-1-ylethyl)-1,2-oxazole (CID 13688) is 5-methyl-3-(2-piperidin-1-ylethyl)-1,2-oxazole.
What is the SMILES notation for 5-methyl-3-(2-piperidin-1-ylethyl)-1,2-oxazole?
The canonical SMILES for 5-methyl-3-(2-piperidin-1-ylethyl)-1,2-oxazole is Cc1cc(CCN2CCCCC2)no1.
What is the InChIKey of 5-methyl-3-(2-piperidin-1-ylethyl)-1,2-oxazole?
The InChIKey is WAFHMWXIPPOZKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-10-9-11(12-14-10)5-8-13-6-3-2-4-7-13/h9H,2-8H2,1H3.
What are the key properties of 5-methyl-3-(2-piperidin-1-ylethyl)-1,2-oxazole?
5-methyl-3-(2-piperidin-1-ylethyl)-1,2-oxazole has a molecular weight of 194.28 g/mol, XLogP of 2.01, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-(2-piperidin-1-ylethyl)-1,2-oxazole is sourced from PubChem (CID 13688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).