2-[2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]ethoxy]ethanol

C17H34N2O3 — CID 111825684

IUPAC2-[2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]ethoxy]ethanol
SMILESCC1CN(CCC2CCN(CCOCCO)CC2)CC(C)O1
InChIInChI=1S/C17H34N2O3/c1-15-13-19(14-16(2)22-15)8-5-17-3-6-18(7-4-17)9-11-21-12-10-20/h15-17,20H,3-14H2,1-2H3
InChIKeyUKDDYKBWVRMUCX-UHFFFAOYSA-N
MW314.47 g/mol
LogP1.21
Rot. Bonds8

About 2-[2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]ethoxy]ethanol

2-[2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]ethoxy]ethanol (PubChem CID 111825684) has the molecular formula C17H34N2O3 and a molecular weight of 314.47 g/mol. Its IUPAC name is 2-[2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]ethoxy]ethanol
PubChem CID111825684
Molecular FormulaC17H34N2O3
Molecular Weight314.47 g/mol
Exact Mass314.26
IUPAC Name2-[2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]ethoxy]ethanol
SMILESCC1CN(CCC2CCN(CCOCCO)CC2)CC(C)O1
InChIInChI=1S/C17H34N2O3/c1-15-13-19(14-16(2)22-15)8-5-17-3-6-18(7-4-17)9-11-21-12-10-20/h15-17,20H,3-14H2,1-2H3
InChIKeyUKDDYKBWVRMUCX-UHFFFAOYSA-N
XLogP1.21
TPSA45.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.47
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol
CID 102934999
2-[2-[2-[(2,6-dimethylmorpholin-4-yl)methyl]pyrrolidin-1-yl]ethoxy]ethanol
CID 111332764
2-[2-[4-(ethoxymethyl)piperidin-1-yl]ethoxy]ethanol
CID 111439736
2-[2-[4-(propylaminomethyl)piperidin-1-yl]ethoxy]ethanol
CID 63849785
(2R,6R)-2,6-dimethyl-4-[2-[1-[[(3S)-oxolan-3-yl]methyl]piperidin-4-yl]ethyl]morpholine
CID 97092866
2-[2-[4-(dimethylamino)piperidin-1-yl]ethoxy]ethanol
CID 61069984
1-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]ethanol
CID 103684371
2-[2-(3-aminoazetidin-1-yl)ethoxy]ethanol
CID 63761317
2-[1-(2-propoxyethyl)pyrrolidin-3-yl]ethanol
CID 106456274
2-[1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]-N,N-dimethylacetamide
CID 110027884
(2S,6R)-4-[[(3R)-1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-2,6-dimethylmorpholine
CID 29183665
(2S,6R)-4-(2-methoxyethyl)-2,6-dimethylmorpholine
CID 89016342

Frequently Asked Questions

What is the IUPAC name of 2-[2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]ethoxy]ethanol?
The IUPAC name of 2-[2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]ethoxy]ethanol (CID 111825684) is 2-[2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]ethoxy]ethanol?
The canonical SMILES for 2-[2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]ethoxy]ethanol is CC1CN(CCC2CCN(CCOCCO)CC2)CC(C)O1.
What is the InChIKey of 2-[2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]ethoxy]ethanol?
The InChIKey is UKDDYKBWVRMUCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O3/c1-15-13-19(14-16(2)22-15)8-5-17-3-6-18(7-4-17)9-11-21-12-10-20/h15-17,20H,3-14H2,1-2H3.
What are the key properties of 2-[2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]ethoxy]ethanol?
2-[2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]ethoxy]ethanol has a molecular weight of 314.47 g/mol, XLogP of 1.21, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]ethoxy]ethanol is sourced from PubChem (CID 111825684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).