(3,3-dimethylmorpholin-4-yl)-(4-methylpiperidin-1-yl)methanone

C13H24N2O2 — CID 116654559

IUPAC(3,3-dimethylmorpholin-4-yl)-(4-methylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)N2CCOCC2(C)C)CC1
InChIInChI=1S/C13H24N2O2/c1-11-4-6-14(7-5-11)12(16)15-8-9-17-10-13(15,2)3/h11H,4-10H2,1-3H3
InChIKeyYXLYOKMMBWPIPI-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.95
Rot. Bonds

About (3,3-dimethylmorpholin-4-yl)-(4-methylpiperidin-1-yl)methanone

(3,3-dimethylmorpholin-4-yl)-(4-methylpiperidin-1-yl)methanone (PubChem CID 116654559) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is (3,3-dimethylmorpholin-4-yl)-(4-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(3,3-dimethylmorpholin-4-yl)-(4-methylpiperidin-1-yl)methanone
PubChem CID116654559
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name(3,3-dimethylmorpholin-4-yl)-(4-methylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)N2CCOCC2(C)C)CC1
InChIInChI=1S/C13H24N2O2/c1-11-4-6-14(7-5-11)12(16)15-8-9-17-10-13(15,2)3/h11H,4-10H2,1-3H3
InChIKeyYXLYOKMMBWPIPI-UHFFFAOYSA-N
XLogP1.95
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3,3-dimethylmorpholin-4-yl)-(4-methylpiperidin-1-yl)methanone?
The IUPAC name of (3,3-dimethylmorpholin-4-yl)-(4-methylpiperidin-1-yl)methanone (CID 116654559) is (3,3-dimethylmorpholin-4-yl)-(4-methylpiperidin-1-yl)methanone.
What is the SMILES notation for (3,3-dimethylmorpholin-4-yl)-(4-methylpiperidin-1-yl)methanone?
The canonical SMILES for (3,3-dimethylmorpholin-4-yl)-(4-methylpiperidin-1-yl)methanone is CC1CCN(C(=O)N2CCOCC2(C)C)CC1.
What is the InChIKey of (3,3-dimethylmorpholin-4-yl)-(4-methylpiperidin-1-yl)methanone?
The InChIKey is YXLYOKMMBWPIPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-11-4-6-14(7-5-11)12(16)15-8-9-17-10-13(15,2)3/h11H,4-10H2,1-3H3.
What are the key properties of (3,3-dimethylmorpholin-4-yl)-(4-methylpiperidin-1-yl)methanone?
(3,3-dimethylmorpholin-4-yl)-(4-methylpiperidin-1-yl)methanone has a molecular weight of 240.35 g/mol, XLogP of 1.95, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3-dimethylmorpholin-4-yl)-(4-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 116654559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).