2-(azetidin-1-yl)-1-morpholin-4-ylethanimine

C9H17N3O — CID 130706300

IUPAC2-(azetidin-1-yl)-1-morpholin-4-ylethanimine
SMILES[H]/N=C(/CN1CCC1)N1CCOCC1
InChIInChI=1S/C9H17N3O/c10-9(8-11-2-1-3-11)12-4-6-13-7-5-12/h10H,1-8H2/b10-9-
InChIKeyXQKMJDHLVFZPSI-KTKRTIGZSA-N
MW183.25 g/mol
LogP0.00
Rot. Bonds2

About 2-(azetidin-1-yl)-1-morpholin-4-ylethanimine

2-(azetidin-1-yl)-1-morpholin-4-ylethanimine (PubChem CID 130706300) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is 2-(azetidin-1-yl)-1-morpholin-4-ylethanimine.

Molecular Properties

Compound Name2-(azetidin-1-yl)-1-morpholin-4-ylethanimine
PubChem CID130706300
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name2-(azetidin-1-yl)-1-morpholin-4-ylethanimine
SMILES[H]/N=C(/CN1CCC1)N1CCOCC1
InChIInChI=1S/C9H17N3O/c10-9(8-11-2-1-3-11)12-4-6-13-7-5-12/h10H,1-8H2/b10-9-
InChIKeyXQKMJDHLVFZPSI-KTKRTIGZSA-N
XLogP0.00
TPSA39.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 2-(azetidin-1-yl)-1-morpholin-4-ylethanimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-1-yl)-1-morpholin-4-ylethanimine?
The IUPAC name of 2-(azetidin-1-yl)-1-morpholin-4-ylethanimine (CID 130706300) is 2-(azetidin-1-yl)-1-morpholin-4-ylethanimine.
What is the SMILES notation for 2-(azetidin-1-yl)-1-morpholin-4-ylethanimine?
The canonical SMILES for 2-(azetidin-1-yl)-1-morpholin-4-ylethanimine is [H]/N=C(/CN1CCC1)N1CCOCC1.
What is the InChIKey of 2-(azetidin-1-yl)-1-morpholin-4-ylethanimine?
The InChIKey is XQKMJDHLVFZPSI-KTKRTIGZSA-N. The full InChI is InChI=1S/C9H17N3O/c10-9(8-11-2-1-3-11)12-4-6-13-7-5-12/h10H,1-8H2/b10-9-.
What are the key properties of 2-(azetidin-1-yl)-1-morpholin-4-ylethanimine?
2-(azetidin-1-yl)-1-morpholin-4-ylethanimine has a molecular weight of 183.25 g/mol, XLogP of 0.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-1-yl)-1-morpholin-4-ylethanimine is sourced from PubChem (CID 130706300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).