(2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine

C14H28N2O2 — CID 114042172

IUPAC(2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine
SMILESCOCC1(CN2C[C@@H](C)O[C@@H](C)C2)CCNCC1
InChIInChI=1S/C14H28N2O2/c1-12-8-16(9-13(2)18-12)10-14(11-17-3)4-6-15-7-5-14/h12-13,15H,4-11H2,1-3H3/t12-,13+
InChIKeyLSYJQJCNZRXCRN-BETUJISGSA-N
MW256.39 g/mol
LogP1.11
Rot. Bonds4

About (2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine

(2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine (PubChem CID 114042172) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is (2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine.

Molecular Properties

Compound Name(2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine
PubChem CID114042172
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name(2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine
SMILESCOCC1(CN2C[C@@H](C)O[C@@H](C)C2)CCNCC1
InChIInChI=1S/C14H28N2O2/c1-12-8-16(9-13(2)18-12)10-14(11-17-3)4-6-15-7-5-14/h12-13,15H,4-11H2,1-3H3/t12-,13+
InChIKeyLSYJQJCNZRXCRN-BETUJISGSA-N
XLogP1.11
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;(2S,6R)-4-[[1-(methoxymethyl)cyclopropyl]methyl]-2,6-dimethylmorpholine
CID 177009766
(2R,6S)-2,6-dimethyl-4-[(4-propylpiperidin-4-yl)methyl]morpholine
CID 104959142
(2R,6S)-4-[(3-ethylpyrrolidin-3-yl)methyl]-2,6-dimethylmorpholine
CID 104959082
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide
CID 120896083
4-[(2,6-dimethylmorpholin-4-yl)methyl]piperidin-4-ol
CID 62221665
4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine
CID 114280638
4-(methoxymethyl)-4-[(3-propylpyrrolidin-1-yl)methyl]piperidine
CID 114042162
[1-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]cyclobutyl]methanethiol
CID 104961708
[1-[(2,6-dimethylmorpholin-4-yl)methyl]cyclopropyl]methanol;ethane
CID 177216803
2-[1-[(2,6-dimethylmorpholin-4-yl)methyl]cyclopropyl]ethanethioamide
CID 65498498
(2R,6S)-4-[[1-(bromomethyl)cyclohexyl]methyl]-2,6-dimethylmorpholine
CID 104959997
3-(2,2-dimethylpropyl)-1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine
CID 170276303

Frequently Asked Questions

What is the IUPAC name of (2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine?
The IUPAC name of (2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine (CID 114042172) is (2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine.
What is the SMILES notation for (2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine?
The canonical SMILES for (2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine is COCC1(CN2C[C@@H](C)O[C@@H](C)C2)CCNCC1.
What is the InChIKey of (2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine?
The InChIKey is LSYJQJCNZRXCRN-BETUJISGSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-12-8-16(9-13(2)18-12)10-14(11-17-3)4-6-15-7-5-14/h12-13,15H,4-11H2,1-3H3/t12-,13+.
What are the key properties of (2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine?
(2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine has a molecular weight of 256.39 g/mol, XLogP of 1.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine is sourced from PubChem (CID 114042172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).