1-(2-morpholin-4-ylethoxy)ethenamine

C8H16N2O2 — CID 89172266

IUPAC1-(2-morpholin-4-ylethoxy)ethenamine
SMILESC=C(N)OCCN1CCOCC1
InChIInChI=1S/C8H16N2O2/c1-8(9)12-7-4-10-2-5-11-6-3-10/h1-7,9H2
InChIKeyRVKFDWSCQBUSOI-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.23
Rot. Bonds4

About 1-(2-morpholin-4-ylethoxy)ethenamine

1-(2-morpholin-4-ylethoxy)ethenamine (PubChem CID 89172266) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 1-(2-morpholin-4-ylethoxy)ethenamine.

Molecular Properties

Compound Name1-(2-morpholin-4-ylethoxy)ethenamine
PubChem CID89172266
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name1-(2-morpholin-4-ylethoxy)ethenamine
SMILESC=C(N)OCCN1CCOCC1
InChIInChI=1S/C8H16N2O2/c1-8(9)12-7-4-10-2-5-11-6-3-10/h1-7,9H2
InChIKeyRVKFDWSCQBUSOI-UHFFFAOYSA-N
XLogP-0.23
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-ylethoxy)ethenamine?
The IUPAC name of 1-(2-morpholin-4-ylethoxy)ethenamine (CID 89172266) is 1-(2-morpholin-4-ylethoxy)ethenamine.
What is the SMILES notation for 1-(2-morpholin-4-ylethoxy)ethenamine?
The canonical SMILES for 1-(2-morpholin-4-ylethoxy)ethenamine is C=C(N)OCCN1CCOCC1.
What is the InChIKey of 1-(2-morpholin-4-ylethoxy)ethenamine?
The InChIKey is RVKFDWSCQBUSOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-8(9)12-7-4-10-2-5-11-6-3-10/h1-7,9H2.
What are the key properties of 1-(2-morpholin-4-ylethoxy)ethenamine?
1-(2-morpholin-4-ylethoxy)ethenamine has a molecular weight of 172.23 g/mol, XLogP of -0.23, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-ylethoxy)ethenamine is sourced from PubChem (CID 89172266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).