(4-methoxy-4-methylpiperidin-1-yl)-(1,2-oxazol-3-yl)methanone

C11H16N2O3 — CID 136520423

IUPAC(4-methoxy-4-methylpiperidin-1-yl)-(1,2-oxazol-3-yl)methanone
SMILESCOC1(C)CCN(C(=O)c2ccon2)CC1
InChIInChI=1S/C11H16N2O3/c1-11(15-2)4-6-13(7-5-11)10(14)9-3-8-16-12-9/h3,8H,4-7H2,1-2H3
InChIKeyQIWOILIWFGQXCS-UHFFFAOYSA-N
MW224.26 g/mol
LogP1.32
Rot. Bonds2

About (4-methoxy-4-methylpiperidin-1-yl)-(1,2-oxazol-3-yl)methanone

(4-methoxy-4-methylpiperidin-1-yl)-(1,2-oxazol-3-yl)methanone (PubChem CID 136520423) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is (4-methoxy-4-methylpiperidin-1-yl)-(1,2-oxazol-3-yl)methanone.

Molecular Properties

Compound Name(4-methoxy-4-methylpiperidin-1-yl)-(1,2-oxazol-3-yl)methanone
PubChem CID136520423
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name(4-methoxy-4-methylpiperidin-1-yl)-(1,2-oxazol-3-yl)methanone
SMILESCOC1(C)CCN(C(=O)c2ccon2)CC1
InChIInChI=1S/C11H16N2O3/c1-11(15-2)4-6-13(7-5-11)10(14)9-3-8-16-12-9/h3,8H,4-7H2,1-2H3
InChIKeyQIWOILIWFGQXCS-UHFFFAOYSA-N
XLogP1.32
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-methoxy-4-methylpiperidin-1-yl)-(1,2-oxazol-3-yl)methanone?
The IUPAC name of (4-methoxy-4-methylpiperidin-1-yl)-(1,2-oxazol-3-yl)methanone (CID 136520423) is (4-methoxy-4-methylpiperidin-1-yl)-(1,2-oxazol-3-yl)methanone.
What is the SMILES notation for (4-methoxy-4-methylpiperidin-1-yl)-(1,2-oxazol-3-yl)methanone?
The canonical SMILES for (4-methoxy-4-methylpiperidin-1-yl)-(1,2-oxazol-3-yl)methanone is COC1(C)CCN(C(=O)c2ccon2)CC1.
What is the InChIKey of (4-methoxy-4-methylpiperidin-1-yl)-(1,2-oxazol-3-yl)methanone?
The InChIKey is QIWOILIWFGQXCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-11(15-2)4-6-13(7-5-11)10(14)9-3-8-16-12-9/h3,8H,4-7H2,1-2H3.
What are the key properties of (4-methoxy-4-methylpiperidin-1-yl)-(1,2-oxazol-3-yl)methanone?
(4-methoxy-4-methylpiperidin-1-yl)-(1,2-oxazol-3-yl)methanone has a molecular weight of 224.26 g/mol, XLogP of 1.32, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-4-methylpiperidin-1-yl)-(1,2-oxazol-3-yl)methanone is sourced from PubChem (CID 136520423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).