4-morpholin-4-ylcyclohex-2-en-1-imine

C10H16N2O — CID 91577879

IUPAC4-morpholin-4-ylcyclohex-2-en-1-imine
SMILES[H]/N=C1/C=CC(N2CCOCC2)CC1
InChIInChI=1S/C10H16N2O/c11-9-1-3-10(4-2-9)12-5-7-13-8-6-12/h1,3,10-11H,2,4-8H2/b11-9-
InChIKeyKZRRNABQUZILII-LUAWRHEFSA-N
MW180.25 g/mol
LogP1.06
Rot. Bonds1

About 4-morpholin-4-ylcyclohex-2-en-1-imine

4-morpholin-4-ylcyclohex-2-en-1-imine (PubChem CID 91577879) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 4-morpholin-4-ylcyclohex-2-en-1-imine.

Molecular Properties

Compound Name4-morpholin-4-ylcyclohex-2-en-1-imine
PubChem CID91577879
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name4-morpholin-4-ylcyclohex-2-en-1-imine
SMILES[H]/N=C1/C=CC(N2CCOCC2)CC1
InChIInChI=1S/C10H16N2O/c11-9-1-3-10(4-2-9)12-5-7-13-8-6-12/h1,3,10-11H,2,4-8H2/b11-9-
InChIKeyKZRRNABQUZILII-LUAWRHEFSA-N
XLogP1.06
TPSA36.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-ylcyclohex-2-en-1-imine?
The IUPAC name of 4-morpholin-4-ylcyclohex-2-en-1-imine (CID 91577879) is 4-morpholin-4-ylcyclohex-2-en-1-imine.
What is the SMILES notation for 4-morpholin-4-ylcyclohex-2-en-1-imine?
The canonical SMILES for 4-morpholin-4-ylcyclohex-2-en-1-imine is [H]/N=C1/C=CC(N2CCOCC2)CC1.
What is the InChIKey of 4-morpholin-4-ylcyclohex-2-en-1-imine?
The InChIKey is KZRRNABQUZILII-LUAWRHEFSA-N. The full InChI is InChI=1S/C10H16N2O/c11-9-1-3-10(4-2-9)12-5-7-13-8-6-12/h1,3,10-11H,2,4-8H2/b11-9-.
What are the key properties of 4-morpholin-4-ylcyclohex-2-en-1-imine?
4-morpholin-4-ylcyclohex-2-en-1-imine has a molecular weight of 180.25 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-ylcyclohex-2-en-1-imine is sourced from PubChem (CID 91577879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).