(2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone

C11H21N3O2 — CID 63103811

IUPAC(2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone
SMILESCC1CN(C(=O)C2CNCCN2)C(C)CO1
InChIInChI=1S/C11H21N3O2/c1-8-7-16-9(2)6-14(8)11(15)10-5-12-3-4-13-10/h8-10,12-13H,3-7H2,1-2H3
InChIKeyJQEXUKZNEBXRJZ-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.82
Rot. Bonds1

About (2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone

(2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone (PubChem CID 63103811) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is (2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone.

Molecular Properties

Compound Name(2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone
PubChem CID63103811
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name(2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone
SMILESCC1CN(C(=O)C2CNCCN2)C(C)CO1
InChIInChI=1S/C11H21N3O2/c1-8-7-16-9(2)6-14(8)11(15)10-5-12-3-4-13-10/h8-10,12-13H,3-7H2,1-2H3
InChIKeyJQEXUKZNEBXRJZ-UHFFFAOYSA-N
XLogP-0.82
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(5-ethyl-2-methylmorpholin-4-yl)-piperazin-2-ylmethanone
CID 63104526
(2,5-dimethylmorpholin-4-yl)-[(2R)-pyrrolidin-2-yl]methanone
CID 103795429
(2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride
CID 119292459
5-(2,5-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one
CID 110744411
(2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone
CID 63103466
1-(2,5-dimethylmorpholin-4-yl)-2-methyl-2-piperidin-3-ylpropan-1-one
CID 83199879
cyclobutyl-(2,5-dimethylmorpholin-4-yl)methanone
CID 110727653
(2R,5S)-5-(2,5-dimethylmorpholine-4-carbonyl)oxolane-2-carboxylic acid
CID 102944408
(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-piperazin-2-ylmethanone
CID 102883594
[2-(hydroxymethyl)-5-methylmorpholin-4-yl]-(5-methylpiperazin-2-yl)methanone
CID 81203509
[2-(hydroxymethyl)-5-methylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone
CID 104901299
(5-ethyl-2-methylmorpholin-4-yl)-(4-methylpiperidin-2-yl)methanone
CID 114422854

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone?
The IUPAC name of (2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone (CID 63103811) is (2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone.
What is the SMILES notation for (2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone?
The canonical SMILES for (2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone is CC1CN(C(=O)C2CNCCN2)C(C)CO1.
What is the InChIKey of (2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone?
The InChIKey is JQEXUKZNEBXRJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-8-7-16-9(2)6-14(8)11(15)10-5-12-3-4-13-10/h8-10,12-13H,3-7H2,1-2H3.
What are the key properties of (2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone?
(2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone has a molecular weight of 227.31 g/mol, XLogP of -0.82, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone is sourced from PubChem (CID 63103811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).