N-hexyl-1-morpholin-4-ylmethanimine

C11H22N2O — CID 523950

IUPACN-hexyl-1-morpholin-4-ylmethanimine
SMILESCCCCCC/N=C/N1CCOCC1
InChIInChI=1S/C11H22N2O/c1-2-3-4-5-6-12-11-13-7-9-14-10-8-13/h11H,2-10H2,1H3/b12-11+
InChIKeyOUCAHGTWGIGIJK-VAWYXSNFSA-N
MW198.31 g/mol
LogP1.93
Rot. Bonds6

About N-hexyl-1-morpholin-4-ylmethanimine

N-hexyl-1-morpholin-4-ylmethanimine (PubChem CID 523950) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N-hexyl-1-morpholin-4-ylmethanimine.

Molecular Properties

Compound NameN-hexyl-1-morpholin-4-ylmethanimine
PubChem CID523950
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN-hexyl-1-morpholin-4-ylmethanimine
SMILESCCCCCC/N=C/N1CCOCC1
InChIInChI=1S/C11H22N2O/c1-2-3-4-5-6-12-11-13-7-9-14-10-8-13/h11H,2-10H2,1H3/b12-11+
InChIKeyOUCAHGTWGIGIJK-VAWYXSNFSA-N
XLogP1.93
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-hexyl-1-morpholin-4-ylmethanimine 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 N-hexyl-1-morpholin-4-ylmethanimine?
The IUPAC name of N-hexyl-1-morpholin-4-ylmethanimine (CID 523950) is N-hexyl-1-morpholin-4-ylmethanimine.
What is the SMILES notation for N-hexyl-1-morpholin-4-ylmethanimine?
The canonical SMILES for N-hexyl-1-morpholin-4-ylmethanimine is CCCCCC/N=C/N1CCOCC1.
What is the InChIKey of N-hexyl-1-morpholin-4-ylmethanimine?
The InChIKey is OUCAHGTWGIGIJK-VAWYXSNFSA-N. The full InChI is InChI=1S/C11H22N2O/c1-2-3-4-5-6-12-11-13-7-9-14-10-8-13/h11H,2-10H2,1H3/b12-11+.
What are the key properties of N-hexyl-1-morpholin-4-ylmethanimine?
N-hexyl-1-morpholin-4-ylmethanimine has a molecular weight of 198.31 g/mol, XLogP of 1.93, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hexyl-1-morpholin-4-ylmethanimine is sourced from PubChem (CID 523950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).