1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine

C16H23NO4 — CID 140553290

IUPAC1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine
SMILESCOc1ccc(C(C)=NOCCOC2CCCCO2)cc1
InChIInChI=1S/C16H23NO4/c1-13(14-6-8-15(18-2)9-7-14)17-21-12-11-20-16-5-3-4-10-19-16/h6-9,16H,3-5,10-12H2,1-2H3
InChIKeyFQORVLACZYANGL-UHFFFAOYSA-N
MW293.36 g/mol
LogP2.98
Rot. Bonds7

About 1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine

1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine (PubChem CID 140553290) has the molecular formula C16H23NO4 and a molecular weight of 293.36 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine
PubChem CID140553290
Molecular FormulaC16H23NO4
Molecular Weight293.36 g/mol
Exact Mass293.16
IUPAC Name1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine
SMILESCOc1ccc(C(C)=NOCCOC2CCCCO2)cc1
InChIInChI=1S/C16H23NO4/c1-13(14-6-8-15(18-2)9-7-14)17-21-12-11-20-16-5-3-4-10-19-16/h6-9,16H,3-5,10-12H2,1-2H3
InChIKeyFQORVLACZYANGL-UHFFFAOYSA-N
XLogP2.98
TPSA49.28 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.36
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine 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

1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine
CID 140553282
2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane
CID 11265153
4-[2-[1-(4-methoxyphenyl)ethylideneamino]oxyethoxy]piperidine-1-carboxylic acid
CID 87578431
2-[(4-methoxyphenyl)methoxy]oxolane
CID 10899818
methyl 4-[12-(oxan-2-yloxy)dodecoxy]benzoate
CID 67066837
2-(2-phenoxyethoxy)oxane
CID 11736193
2-(4-methoxyphenoxy)oxolane
CID 135060561
2-[4-(4-methoxyphenyl)buta-2,3-dienoxy]oxane
CID 44519885
methyl 4-[2-[2-(oxolan-2-yloxy)ethoxy]ethoxy]benzoate
CID 102002140
2-[(3,5-dimethoxyphenyl)methoxy]oxane
CID 173090369
3-[4-[2-(oxan-2-yloxy)ethoxy]phenyl]-3-oxopropanal
CID 137354800
methyl 4-methylbenzoate;1-(4-methylphenyl)-3-[4-[2-(oxan-2-yloxy)ethoxy]phenyl]propane-1,3-dione;1-[4-[2-(oxan-2-yloxy)ethoxy]phenyl]ethanone
CID 159447558

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine?
The IUPAC name of 1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine (CID 140553290) is 1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine.
What is the SMILES notation for 1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine?
The canonical SMILES for 1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine is COc1ccc(C(C)=NOCCOC2CCCCO2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine?
The InChIKey is FQORVLACZYANGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO4/c1-13(14-6-8-15(18-2)9-7-14)17-21-12-11-20-16-5-3-4-10-19-16/h6-9,16H,3-5,10-12H2,1-2H3.
What are the key properties of 1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine?
1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine has a molecular weight of 293.36 g/mol, XLogP of 2.98, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N-[2-(oxan-2-yloxy)ethoxy]ethanimine is sourced from PubChem (CID 140553290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).