2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine

C13H26N2O2 — CID 62559706

IUPAC2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine
SMILESCCC1COCCN1CCNCC1CCOC1
InChIInChI=1S/C13H26N2O2/c1-2-13-11-17-8-6-15(13)5-4-14-9-12-3-7-16-10-12/h12-14H,2-11H2,1H3
InChIKeyCIAGRGXXKBEVHM-UHFFFAOYSA-N
MW242.36 g/mol
LogP0.72
Rot. Bonds6

About 2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine

2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine (PubChem CID 62559706) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine
PubChem CID62559706
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine
SMILESCCC1COCCN1CCNCC1CCOC1
InChIInChI=1S/C13H26N2O2/c1-2-13-11-17-8-6-15(13)5-4-14-9-12-3-7-16-10-12/h12-14H,2-11H2,1H3
InChIKeyCIAGRGXXKBEVHM-UHFFFAOYSA-N
XLogP0.72
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(cyclopentylmethyl)-2-(3-ethylmorpholin-4-yl)ethanamine
CID 55089657
2-(2-ethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine
CID 62575587
2-(5-ethyl-2-methylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine
CID 62557885
N-[2-(3-ethylmorpholin-4-yl)ethyl]-3-methylbutan-1-amine
CID 62561761
2-(2,4-dimethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine
CID 62560487
N-(oxolan-3-ylmethyl)propan-1-amine
CID 22355248
2-(3-ethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine
CID 55090292
1-cyclopropyl-N-[2-(3-ethylmorpholin-4-yl)ethyl]ethanamine
CID 62560823
N-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine
CID 60867675
2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine
CID 55159679
1-[2-(3-ethylmorpholin-4-yl)ethyl]piperidin-4-amine
CID 79328207
N-[4-(3-ethylmorpholin-4-yl)butyl]cyclopropanamine
CID 62432568

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine?
The IUPAC name of 2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine (CID 62559706) is 2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine.
What is the SMILES notation for 2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine?
The canonical SMILES for 2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine is CCC1COCCN1CCNCC1CCOC1.
What is the InChIKey of 2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine?
The InChIKey is CIAGRGXXKBEVHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-2-13-11-17-8-6-15(13)5-4-14-9-12-3-7-16-10-12/h12-14H,2-11H2,1H3.
What are the key properties of 2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine?
2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine has a molecular weight of 242.36 g/mol, XLogP of 0.72, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine is sourced from PubChem (CID 62559706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).