6-(aminomethyl)-4-(1-methylpiperidin-4-yl)morpholin-3-one

C11H21N3O2 — CID 115102895

IUPAC6-(aminomethyl)-4-(1-methylpiperidin-4-yl)morpholin-3-one
SMILESCN1CCC(N2CC(CN)OCC2=O)CC1
InChIInChI=1S/C11H21N3O2/c1-13-4-2-9(3-5-13)14-7-10(6-12)16-8-11(14)15/h9-10H,2-8,12H2,1H3
InChIKeyIYMQSCFDTKGDCS-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.73
Rot. Bonds2

About 6-(aminomethyl)-4-(1-methylpiperidin-4-yl)morpholin-3-one

6-(aminomethyl)-4-(1-methylpiperidin-4-yl)morpholin-3-one (PubChem CID 115102895) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 6-(aminomethyl)-4-(1-methylpiperidin-4-yl)morpholin-3-one.

Molecular Properties

Compound Name6-(aminomethyl)-4-(1-methylpiperidin-4-yl)morpholin-3-one
PubChem CID115102895
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name6-(aminomethyl)-4-(1-methylpiperidin-4-yl)morpholin-3-one
SMILESCN1CCC(N2CC(CN)OCC2=O)CC1
InChIInChI=1S/C11H21N3O2/c1-13-4-2-9(3-5-13)14-7-10(6-12)16-8-11(14)15/h9-10H,2-8,12H2,1H3
InChIKeyIYMQSCFDTKGDCS-UHFFFAOYSA-N
XLogP-0.73
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(aminomethyl)-4-(1-methylpiperidin-2-yl)morpholin-3-one
CID 115102999
6-(aminomethyl)-4-methylmorpholin-3-one;hydrochloride
CID 75531174
(5R)-5-(hydroxymethyl)-3-(1-methylpiperidin-4-yl)-1,3-oxazolidin-2-one
CID 115056583
(6S)-6-(aminomethyl)-4-(2-methoxyethyl)morpholin-3-one
CID 42249905
6-(aminomethyl)-4-(2,3,5,6-tetramethylphenyl)morpholin-3-one
CID 116838153
(5S)-5-(aminomethyl)-3-(1-methylpiperidin-3-yl)-1,3-oxazolidin-2-one
CID 115056639
4-[1-(3-aminopropanoyl)piperidin-4-yl]-6-[(4-fluorophenoxy)methyl]morpholin-3-one;hydrochloride
CID 154919485
5-(aminomethyl)-4-(1-methylpyrrolidin-3-yl)morpholin-3-one
CID 115102568
(6R)-4-(1-ethylpiperidin-4-yl)-6-[(4-fluorophenoxy)methyl]morpholin-3-one
CID 125161379
(5S)-5-(aminomethyl)-3-(1-ethylpyrrolidin-3-yl)-1,3-oxazolidin-2-one
CID 115056557
1-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-sulfonyl chloride
CID 168711327
4-amino-1-(1-methylpyrrolidin-3-yl)pyrrolidin-2-one
CID 61465092

Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-4-(1-methylpiperidin-4-yl)morpholin-3-one?
The IUPAC name of 6-(aminomethyl)-4-(1-methylpiperidin-4-yl)morpholin-3-one (CID 115102895) is 6-(aminomethyl)-4-(1-methylpiperidin-4-yl)morpholin-3-one.
What is the SMILES notation for 6-(aminomethyl)-4-(1-methylpiperidin-4-yl)morpholin-3-one?
The canonical SMILES for 6-(aminomethyl)-4-(1-methylpiperidin-4-yl)morpholin-3-one is CN1CCC(N2CC(CN)OCC2=O)CC1.
What is the InChIKey of 6-(aminomethyl)-4-(1-methylpiperidin-4-yl)morpholin-3-one?
The InChIKey is IYMQSCFDTKGDCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-13-4-2-9(3-5-13)14-7-10(6-12)16-8-11(14)15/h9-10H,2-8,12H2,1H3.
What are the key properties of 6-(aminomethyl)-4-(1-methylpiperidin-4-yl)morpholin-3-one?
6-(aminomethyl)-4-(1-methylpiperidin-4-yl)morpholin-3-one has a molecular weight of 227.31 g/mol, XLogP of -0.73, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-4-(1-methylpiperidin-4-yl)morpholin-3-one is sourced from PubChem (CID 115102895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).