[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-1-yl)methanone

C13H24N2O3 — CID 102932402

IUPAC[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-1-yl)methanone
SMILESCC1CCCN(C(=O)N2CC(C)OC(CO)C2)C1
InChIInChI=1S/C13H24N2O3/c1-10-4-3-5-14(6-10)13(17)15-7-11(2)18-12(8-15)9-16/h10-12,16H,3-9H2,1-2H3
InChIKeyHDCBMMVLRCCPSH-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.92
Rot. Bonds1

About [2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-1-yl)methanone

[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-1-yl)methanone (PubChem CID 102932402) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is [2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-1-yl)methanone
PubChem CID102932402
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC Name[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-1-yl)methanone
SMILESCC1CCCN(C(=O)N2CC(C)OC(CO)C2)C1
InChIInChI=1S/C13H24N2O3/c1-10-4-3-5-14(6-10)13(17)15-7-11(2)18-12(8-15)9-16/h10-12,16H,3-9H2,1-2H3
InChIKeyHDCBMMVLRCCPSH-UHFFFAOYSA-N
XLogP0.92
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-bicyclo[3.1.0]hexanyl-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]methanone
CID 102934154
[(2R,6S)-2,6-dimethylmorpholin-4-yl]-pyrrolidin-1-ylmethanone
CID 103931869
1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]but-2-yn-1-one
CID 107989722
1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-2-(propan-2-ylamino)ethanone
CID 102932666
2,2-difluoro-1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethanone
CID 103514025
1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-2-methylsulfanylethanone
CID 102934667
1-[4-(3-methylpiperidine-1-carbonyl)piperazin-1-yl]ethanone
CID 108988685
[(3S)-3-methylpiperazin-1-yl]-(3-methylpiperidin-1-yl)methanone
CID 104976373
2-[2-(hydroxymethyl)-6-methylmorpholine-4-carbonyl]cyclopropane-1-carboxylic acid
CID 102932290
[4-(2-hydroxyethyl)piperazin-1-yl]-(3-methylpiperidin-1-yl)methanone
CID 79160343
[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-2-yl)methanone
CID 102933001
5-hydroxy-1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]pentan-1-one
CID 102938984

Frequently Asked Questions

What is the IUPAC name of [2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-1-yl)methanone?
The IUPAC name of [2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-1-yl)methanone (CID 102932402) is [2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-1-yl)methanone.
What is the SMILES notation for [2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-1-yl)methanone?
The canonical SMILES for [2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-1-yl)methanone is CC1CCCN(C(=O)N2CC(C)OC(CO)C2)C1.
What is the InChIKey of [2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-1-yl)methanone?
The InChIKey is HDCBMMVLRCCPSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-10-4-3-5-14(6-10)13(17)15-7-11(2)18-12(8-15)9-16/h10-12,16H,3-9H2,1-2H3.
What are the key properties of [2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-1-yl)methanone?
[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-1-yl)methanone has a molecular weight of 256.35 g/mol, XLogP of 0.92, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(hydroxymethyl)-6-methylmorpholin-4-yl]-(3-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 102932402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).