(2S,5S)-2-ethyl-5-methylmorpholine

C7H15NO — CID 93264101

IUPAC(2S,5S)-2-ethyl-5-methylmorpholine
SMILESCC[C@H]1CN[C@@H](C)CO1
InChIInChI=1S/C7H15NO/c1-3-7-4-8-6(2)5-9-7/h6-8H,3-5H2,1-2H3/t6-,7-/m0/s1
InChIKeyWISZZHKHSREDOZ-BQBZGAKWSA-N
MW129.20 g/mol
LogP0.77
Rot. Bonds1

About (2S,5S)-2-ethyl-5-methylmorpholine

(2S,5S)-2-ethyl-5-methylmorpholine (PubChem CID 93264101) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is (2S,5S)-2-ethyl-5-methylmorpholine.

Molecular Properties

Compound Name(2S,5S)-2-ethyl-5-methylmorpholine
PubChem CID93264101
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name(2S,5S)-2-ethyl-5-methylmorpholine
SMILESCC[C@H]1CN[C@@H](C)CO1
InChIInChI=1S/C7H15NO/c1-3-7-4-8-6(2)5-9-7/h6-8H,3-5H2,1-2H3/t6-,7-/m0/s1
InChIKeyWISZZHKHSREDOZ-BQBZGAKWSA-N
XLogP0.77
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(2R)-5-methylmorpholin-2-yl]methanol
CID 155273553
N-ethyl-N-[[(2S,5S)-5-methylmorpholin-2-yl]methyl]ethanamine
CID 58650610
N,N-dimethyl-1-[(2R,5R)-5-methylmorpholin-2-yl]methanamine
CID 45088569
(2S,5S)-2-(methoxymethyl)-5-methylmorpholine
CID 55300146
N,N-dimethyl-1-[(5R)-5-methylmorpholin-2-yl]methanamine
CID 142866340
(2S,5R)-2-(methoxymethyl)-5-methylmorpholine
CID 155290225
(5R)-2-(methoxymethyl)-5-methylmorpholine;hydrochloride
CID 155291476
(2S)-2-[2-(4-fluorophenyl)ethyl]-5-methylmorpholine
CID 67538727
(2R,5S)-2,5-dimethylmorpholine
CID 641780
5-methylmorpholin-2-ol
CID 105427098
(2R)-2-ethyl-5-methyloxane
CID 146845250
2-fluoro-5-methylmorpholine
CID 105427159

Frequently Asked Questions

What is the IUPAC name of (2S,5S)-2-ethyl-5-methylmorpholine?
The IUPAC name of (2S,5S)-2-ethyl-5-methylmorpholine (CID 93264101) is (2S,5S)-2-ethyl-5-methylmorpholine.
What is the SMILES notation for (2S,5S)-2-ethyl-5-methylmorpholine?
The canonical SMILES for (2S,5S)-2-ethyl-5-methylmorpholine is CC[C@H]1CN[C@@H](C)CO1.
What is the InChIKey of (2S,5S)-2-ethyl-5-methylmorpholine?
The InChIKey is WISZZHKHSREDOZ-BQBZGAKWSA-N. The full InChI is InChI=1S/C7H15NO/c1-3-7-4-8-6(2)5-9-7/h6-8H,3-5H2,1-2H3/t6-,7-/m0/s1.
What are the key properties of (2S,5S)-2-ethyl-5-methylmorpholine?
(2S,5S)-2-ethyl-5-methylmorpholine has a molecular weight of 129.20 g/mol, XLogP of 0.77, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,5S)-2-ethyl-5-methylmorpholine is sourced from PubChem (CID 93264101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).