2-(1-methylpiperidin-4-yl)oxy-1-morpholin-4-ylethanone

C12H22N2O3 — CID 59011794

IUPAC2-(1-methylpiperidin-4-yl)oxy-1-morpholin-4-ylethanone
SMILESCN1CCC(OCC(=O)N2CCOCC2)CC1
InChIInChI=1S/C12H22N2O3/c1-13-4-2-11(3-5-13)17-10-12(15)14-6-8-16-9-7-14/h11H,2-10H2,1H3
InChIKeyUPCWPUXUACCQSN-UHFFFAOYSA-N
MW242.32 g/mol
LogP-0.04
Rot. Bonds3

About 2-(1-methylpiperidin-4-yl)oxy-1-morpholin-4-ylethanone

2-(1-methylpiperidin-4-yl)oxy-1-morpholin-4-ylethanone (PubChem CID 59011794) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-(1-methylpiperidin-4-yl)oxy-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-(1-methylpiperidin-4-yl)oxy-1-morpholin-4-ylethanone
PubChem CID59011794
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC Name2-(1-methylpiperidin-4-yl)oxy-1-morpholin-4-ylethanone
SMILESCN1CCC(OCC(=O)N2CCOCC2)CC1
InChIInChI=1S/C12H22N2O3/c1-13-4-2-11(3-5-13)17-10-12(15)14-6-8-16-9-7-14/h11H,2-10H2,1H3
InChIKeyUPCWPUXUACCQSN-UHFFFAOYSA-N
XLogP-0.04
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 5-0.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpiperidin-4-yl)oxy-1-morpholin-4-ylethanone?
The IUPAC name of 2-(1-methylpiperidin-4-yl)oxy-1-morpholin-4-ylethanone (CID 59011794) is 2-(1-methylpiperidin-4-yl)oxy-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-(1-methylpiperidin-4-yl)oxy-1-morpholin-4-ylethanone?
The canonical SMILES for 2-(1-methylpiperidin-4-yl)oxy-1-morpholin-4-ylethanone is CN1CCC(OCC(=O)N2CCOCC2)CC1.
What is the InChIKey of 2-(1-methylpiperidin-4-yl)oxy-1-morpholin-4-ylethanone?
The InChIKey is UPCWPUXUACCQSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3/c1-13-4-2-11(3-5-13)17-10-12(15)14-6-8-16-9-7-14/h11H,2-10H2,1H3.
What are the key properties of 2-(1-methylpiperidin-4-yl)oxy-1-morpholin-4-ylethanone?
2-(1-methylpiperidin-4-yl)oxy-1-morpholin-4-ylethanone has a molecular weight of 242.32 g/mol, XLogP of -0.04, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpiperidin-4-yl)oxy-1-morpholin-4-ylethanone is sourced from PubChem (CID 59011794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).