3-[(4-methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one

C11H18N2O2 — CID 104788606

IUPAC3-[(4-methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one
SMILESCN1CCOC(CNC2=CC(=O)CC2)C1
InChIInChI=1S/C11H18N2O2/c1-13-4-5-15-11(8-13)7-12-9-2-3-10(14)6-9/h6,11-12H,2-5,7-8H2,1H3
InChIKeyXQEXUNNFUMQOSL-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.15
Rot. Bonds3

About 3-[(4-methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one

3-[(4-methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one (PubChem CID 104788606) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 3-[(4-methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one.

Molecular Properties

Compound Name3-[(4-methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one
PubChem CID104788606
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name3-[(4-methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one
SMILESCN1CCOC(CNC2=CC(=O)CC2)C1
InChIInChI=1S/C11H18N2O2/c1-13-4-5-15-11(8-13)7-12-9-2-3-10(14)6-9/h6,11-12H,2-5,7-8H2,1H3
InChIKeyXQEXUNNFUMQOSL-UHFFFAOYSA-N
XLogP0.15
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-Morpholinocyclopent-2-en-1-one
CID 13761654
5-Amino-3-morpholin-4-ylcyclohex-2-en-1-one
CID 123811032
2,6-Dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one
CID 79884499
2,6-Dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one
CID 79884588
3-(2-Methoxypropylamino)cyclopent-2-en-1-one
CID 102699006
3-(3-Methoxypiperidin-1-yl)cyclopent-2-en-1-one
CID 102958828
3-(2,6-Dimethylmorpholin-4-yl)cyclopent-2-en-1-one
CID 104787633
3-(2-Methylmorpholin-4-yl)cyclopent-2-en-1-one
CID 104787636
3-(3-Methylmorpholin-4-yl)cyclopent-2-en-1-one
CID 104787713
3-(2,5-Dimethylmorpholin-4-yl)cyclopent-2-en-1-one
CID 104787714
3-(2-Ethylmorpholin-4-yl)cyclopent-2-en-1-one
CID 104787715
3-(2,2-Dimethylmorpholin-4-yl)cyclopent-2-en-1-one
CID 104787729

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one?
The IUPAC name of 3-[(4-methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one (CID 104788606) is 3-[(4-methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one.
What is the SMILES notation for 3-[(4-methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one?
The canonical SMILES for 3-[(4-methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one is CN1CCOC(CNC2=CC(=O)CC2)C1.
What is the InChIKey of 3-[(4-methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one?
The InChIKey is XQEXUNNFUMQOSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-13-4-5-15-11(8-13)7-12-9-2-3-10(14)6-9/h6,11-12H,2-5,7-8H2,1H3.
What are the key properties of 3-[(4-methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one?
3-[(4-methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one has a molecular weight of 210.28 g/mol, XLogP of 0.15, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one is sourced from PubChem (CID 104788606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).