5-methyl-2-(1-methylpiperidin-3-yl)-1,3-oxazole

C10H16N2O — CID 19018558

IUPAC5-methyl-2-(1-methylpiperidin-3-yl)-1,3-oxazole
SMILESCc1cnc(C2CCCN(C)C2)o1
InChIInChI=1S/C10H16N2O/c1-8-6-11-10(13-8)9-4-3-5-12(2)7-9/h6,9H,3-5,7H2,1-2H3
InChIKeyZWNBYBXWSIFTMR-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.79
Rot. Bonds1

About 5-methyl-2-(1-methylpiperidin-3-yl)-1,3-oxazole

5-methyl-2-(1-methylpiperidin-3-yl)-1,3-oxazole (PubChem CID 19018558) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 5-methyl-2-(1-methylpiperidin-3-yl)-1,3-oxazole.

Molecular Properties

Compound Name5-methyl-2-(1-methylpiperidin-3-yl)-1,3-oxazole
PubChem CID19018558
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name5-methyl-2-(1-methylpiperidin-3-yl)-1,3-oxazole
SMILESCc1cnc(C2CCCN(C)C2)o1
InChIInChI=1S/C10H16N2O/c1-8-6-11-10(13-8)9-4-3-5-12(2)7-9/h6,9H,3-5,7H2,1-2H3
InChIKeyZWNBYBXWSIFTMR-UHFFFAOYSA-N
XLogP1.79
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(1-methylpiperidin-3-yl)-1,3-oxazole?
The IUPAC name of 5-methyl-2-(1-methylpiperidin-3-yl)-1,3-oxazole (CID 19018558) is 5-methyl-2-(1-methylpiperidin-3-yl)-1,3-oxazole.
What is the SMILES notation for 5-methyl-2-(1-methylpiperidin-3-yl)-1,3-oxazole?
The canonical SMILES for 5-methyl-2-(1-methylpiperidin-3-yl)-1,3-oxazole is Cc1cnc(C2CCCN(C)C2)o1.
What is the InChIKey of 5-methyl-2-(1-methylpiperidin-3-yl)-1,3-oxazole?
The InChIKey is ZWNBYBXWSIFTMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-8-6-11-10(13-8)9-4-3-5-12(2)7-9/h6,9H,3-5,7H2,1-2H3.
What are the key properties of 5-methyl-2-(1-methylpiperidin-3-yl)-1,3-oxazole?
5-methyl-2-(1-methylpiperidin-3-yl)-1,3-oxazole has a molecular weight of 180.25 g/mol, XLogP of 1.79, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(1-methylpiperidin-3-yl)-1,3-oxazole is sourced from PubChem (CID 19018558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).