3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine

C13H26N2O2 — CID 103059609

IUPAC3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine
SMILESCCC1COC(C)CN1CC1COCCC1N
InChIInChI=1S/C13H26N2O2/c1-3-12-9-17-10(2)6-15(12)7-11-8-16-5-4-13(11)14/h10-13H,3-9,14H2,1-2H3
InChIKeyBEUKEIXSWMPDFZ-UHFFFAOYSA-N
MW242.36 g/mol
LogP0.85
Rot. Bonds3

About 3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine

3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine (PubChem CID 103059609) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine.

Molecular Properties

Compound Name3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine
PubChem CID103059609
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine
SMILESCCC1COC(C)CN1CC1COCCC1N
InChIInChI=1S/C13H26N2O2/c1-3-12-9-17-10(2)6-15(12)7-11-8-16-5-4-13(11)14/h10-13H,3-9,14H2,1-2H3
InChIKeyBEUKEIXSWMPDFZ-UHFFFAOYSA-N
XLogP0.85
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cycloheptan-1-amine
CID 62609313
5-ethyl-2-methyl-4-(oxiran-2-ylmethyl)morpholine
CID 61424186
2-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-N-methylcyclopentan-1-amine
CID 62609312
4-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-amine
CID 66236109
2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine
CID 62557885
5-ethyl-2-methyl-4-(pyrrolidin-3-ylmethyl)morpholine
CID 62371779
2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine
CID 62615947
2-(5-ethyl-2-methylmorpholin-4-yl)cyclopentan-1-amine
CID 61424381
2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-ethylcyclohexan-1-amine
CID 62615942
5-ethyl-4-(2-fluoroethyl)-2-methylmorpholine
CID 130685633
3-(5-ethyl-2-methylmorpholin-4-yl)propan-1-ol
CID 60692406
3-[(3,4-dimethylpiperidin-1-yl)methyl]oxan-4-amine
CID 103060887

Frequently Asked Questions

What is the IUPAC name of 3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine?
The IUPAC name of 3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine (CID 103059609) is 3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine.
What is the SMILES notation for 3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine?
The canonical SMILES for 3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine is CCC1COC(C)CN1CC1COCCC1N.
What is the InChIKey of 3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine?
The InChIKey is BEUKEIXSWMPDFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-3-12-9-17-10(2)6-15(12)7-11-8-16-5-4-13(11)14/h10-13H,3-9,14H2,1-2H3.
What are the key properties of 3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine?
3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine has a molecular weight of 242.36 g/mol, XLogP of 0.85, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine is sourced from PubChem (CID 103059609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).