3-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]morpholine

C12H24N2O — CID 104967658

IUPAC3-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]morpholine
SMILESC[C@@H]1CCC[C@H](C)N1CC1COCCN1
InChIInChI=1S/C12H24N2O/c1-10-4-3-5-11(2)14(10)8-12-9-15-7-6-13-12/h10-13H,3-9H2,1-2H3/t10-,11+,12?
InChIKeyTYVDORZYACEHSV-FOSCPWQOSA-N
MW212.34 g/mol
LogP1.24
Rot. Bonds2

About 3-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]morpholine

3-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]morpholine (PubChem CID 104967658) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 3-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]morpholine.

Molecular Properties

Compound Name3-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]morpholine
PubChem CID104967658
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name3-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]morpholine
SMILESC[C@@H]1CCC[C@H](C)N1CC1COCCN1
InChIInChI=1S/C12H24N2O/c1-10-4-3-5-11(2)14(10)8-12-9-15-7-6-13-12/h10-13H,3-9H2,1-2H3/t10-,11+,12?
InChIKeyTYVDORZYACEHSV-FOSCPWQOSA-N
XLogP1.24
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-3-[[(2S)-2-methylpiperidin-1-yl]methyl]morpholine
CID 124746471
(2S,6R)-2,6-dimethyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine
CID 7141709
3-(pyrrolidin-1-ylmethyl)morpholine;dihydrochloride
CID 18915160
3-[(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)methyl]morpholine
CID 79935301
N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120915656
4-[(2,6-dimethylpiperidin-1-yl)methyl]-1,3-thiazolidine
CID 43199796
3-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]morpholine
CID 102819349
3-(2-cyclopentylethyl)morpholine
CID 116928258
(3R)-3-(cyclohexylmethyl)morpholine
CID 132580034
3-(ethylsulfonylmethyl)morpholine
CID 84720172
3-[(2,5-dimethylpyrrol-1-yl)methyl]morpholine
CID 103549624
1-cyclobutyl-N-(morpholin-3-ylmethyl)methanamine
CID 115238071

Frequently Asked Questions

What is the IUPAC name of 3-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]morpholine?
The IUPAC name of 3-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]morpholine (CID 104967658) is 3-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]morpholine.
What is the SMILES notation for 3-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]morpholine?
The canonical SMILES for 3-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]morpholine is C[C@@H]1CCC[C@H](C)N1CC1COCCN1.
What is the InChIKey of 3-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]morpholine?
The InChIKey is TYVDORZYACEHSV-FOSCPWQOSA-N. The full InChI is InChI=1S/C12H24N2O/c1-10-4-3-5-11(2)14(10)8-12-9-15-7-6-13-12/h10-13H,3-9H2,1-2H3/t10-,11+,12?.
What are the key properties of 3-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]morpholine?
3-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]morpholine has a molecular weight of 212.34 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]morpholine is sourced from PubChem (CID 104967658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).