methane;N-(oxan-2-yloxy)methanimine

C7H15NO2 — CID 159649356

IUPACmethane;N-(oxan-2-yloxy)methanimine
SMILESC.C=NOC1CCCCO1
InChIInChI=1S/C6H11NO2.CH4/c1-7-9-6-4-2-3-5-8-6;/h6H,1-5H2;1H4
InChIKeyMRJFFOUXYJPIKA-UHFFFAOYSA-N
MW145.20 g/mol
LogP1.78
Rot. Bonds2

About methane;N-(oxan-2-yloxy)methanimine

methane;N-(oxan-2-yloxy)methanimine (PubChem CID 159649356) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is methane;N-(oxan-2-yloxy)methanimine.

Molecular Properties

Compound Namemethane;N-(oxan-2-yloxy)methanimine
PubChem CID159649356
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Namemethane;N-(oxan-2-yloxy)methanimine
SMILESC.C=NOC1CCCCO1
InChIInChI=1S/C6H11NO2.CH4/c1-7-9-6-4-2-3-5-8-6;/h6H,1-5H2;1H4
InChIKeyMRJFFOUXYJPIKA-UHFFFAOYSA-N
XLogP1.78
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze methane;N-(oxan-2-yloxy)methanimine with MolForge

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

Launch Full Analysis

Related Compounds

ethane;formaldehyde;methane;2-methoxyoxane
CID 161263277
(E)-N-(oxan-2-yloxy)cyclohexanecarboximidoyl chloride
CID 11096875
2-methoxyoxepane
CID 24974084
dimethyl-methylidene-(oxan-2-yloxy)-λ5-iodane
CID 163749083
2-[2-(oxan-2-yloxy)propan-2-yloxy]oxane
CID 18680583
2-cycloheptyloxyoxane
CID 11735764
tris(oxan-2-yl) phosphate
CID 175007883
2-(7-bicyclo[2.2.1]hepta-2,5-dienyloxy)oxane
CID 131843933
2-[(E)-prop-1-enoxy]oxane
CID 12835881
2-(oxetan-3-yloxy)oxane
CID 54083112
2-[(E)-4-(oxan-2-yloxy)but-2-enoxy]oxane
CID 14103518
2-[(2S)-but-3-en-2-yl]oxyoxane
CID 11019115

Frequently Asked Questions

What is the IUPAC name of methane;N-(oxan-2-yloxy)methanimine?
The IUPAC name of methane;N-(oxan-2-yloxy)methanimine (CID 159649356) is methane;N-(oxan-2-yloxy)methanimine.
What is the SMILES notation for methane;N-(oxan-2-yloxy)methanimine?
The canonical SMILES for methane;N-(oxan-2-yloxy)methanimine is C.C=NOC1CCCCO1.
What is the InChIKey of methane;N-(oxan-2-yloxy)methanimine?
The InChIKey is MRJFFOUXYJPIKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2.CH4/c1-7-9-6-4-2-3-5-8-6;/h6H,1-5H2;1H4.
What are the key properties of methane;N-(oxan-2-yloxy)methanimine?
methane;N-(oxan-2-yloxy)methanimine has a molecular weight of 145.20 g/mol, XLogP of 1.78, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methane;N-(oxan-2-yloxy)methanimine is sourced from PubChem (CID 159649356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).