2-[[(2S)-oxiran-2-yl]methyl]morpholine

C7H13NO2 — CID 87626819

IUPAC2-[[(2S)-oxiran-2-yl]methyl]morpholine
SMILESC1COC(C[C@H]2CO2)CN1
InChIInChI=1S/C7H13NO2/c1-2-9-6(4-8-1)3-7-5-10-7/h6-8H,1-5H2/t6?,7-/m0/s1
InChIKeyMYDVVIQQZUDSDK-MLWJPKLSSA-N
MW143.19 g/mol
LogP-0.24
Rot. Bonds2

About 2-[[(2S)-oxiran-2-yl]methyl]morpholine

2-[[(2S)-oxiran-2-yl]methyl]morpholine (PubChem CID 87626819) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is 2-[[(2S)-oxiran-2-yl]methyl]morpholine.

Molecular Properties

Compound Name2-[[(2S)-oxiran-2-yl]methyl]morpholine
PubChem CID87626819
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name2-[[(2S)-oxiran-2-yl]methyl]morpholine
SMILESC1COC(C[C@H]2CO2)CN1
InChIInChI=1S/C7H13NO2/c1-2-9-6(4-8-1)3-7-5-10-7/h6-8H,1-5H2/t6?,7-/m0/s1
InChIKeyMYDVVIQQZUDSDK-MLWJPKLSSA-N
XLogP-0.24
TPSA33.79 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

2-(morpholin-2-ylmethyl)morpholine
CID 18506039
2-(cyclopentylmethyl)morpholine
CID 55278350
2-methyl-6-(morpholin-2-ylmethyl)morpholine
CID 123413521
[(2R)-morpholin-2-yl]methanol;hydrochloride
CID 42614735
2-morpholin-2-ylethanol;hydrofluoride
CID 69116594
2-methyloxirane;2-propylmorpholine
CID 175557051
2-prop-2-enylmorpholine
CID 20536842
(2S)-2-(methoxymethyl)morpholine;(2R)-2-(methoxymethyl)morpholine
CID 163652511
(2S)-2-(methoxymethyl)morpholine
CID 10103206
N-[[(2S)-morpholin-2-yl]methyl]methanesulfonamide
CID 93215764
2-[(3-methylazetidin-1-yl)methyl]morpholine
CID 115324331
2-(oxetan-3-yloxymethyl)morpholine
CID 102606417

Frequently Asked Questions

What is the IUPAC name of 2-[[(2S)-oxiran-2-yl]methyl]morpholine?
The IUPAC name of 2-[[(2S)-oxiran-2-yl]methyl]morpholine (CID 87626819) is 2-[[(2S)-oxiran-2-yl]methyl]morpholine.
What is the SMILES notation for 2-[[(2S)-oxiran-2-yl]methyl]morpholine?
The canonical SMILES for 2-[[(2S)-oxiran-2-yl]methyl]morpholine is C1COC(C[C@H]2CO2)CN1.
What is the InChIKey of 2-[[(2S)-oxiran-2-yl]methyl]morpholine?
The InChIKey is MYDVVIQQZUDSDK-MLWJPKLSSA-N. The full InChI is InChI=1S/C7H13NO2/c1-2-9-6(4-8-1)3-7-5-10-7/h6-8H,1-5H2/t6?,7-/m0/s1.
What are the key properties of 2-[[(2S)-oxiran-2-yl]methyl]morpholine?
2-[[(2S)-oxiran-2-yl]methyl]morpholine has a molecular weight of 143.19 g/mol, XLogP of -0.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2S)-oxiran-2-yl]methyl]morpholine is sourced from PubChem (CID 87626819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).