N-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanimine

C16H19NO2 — CID 118868215

IUPACN-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanimine
SMILESCOc1ccccc1C(C)/N=C(\C)c1ccc(C)o1
InChIInChI=1S/C16H19NO2/c1-11-9-10-15(19-11)13(3)17-12(2)14-7-5-6-8-16(14)18-4/h5-10,12H,1-4H3/b17-13+
InChIKeyWGRMQMXRJOSKBC-GHRIWEEISA-N
MW257.33 g/mol
LogP4.17
Rot. Bonds4

About N-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanimine

N-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanimine (PubChem CID 118868215) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is N-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanimine.

Molecular Properties

Compound NameN-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanimine
PubChem CID118868215
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC NameN-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanimine
SMILESCOc1ccccc1C(C)/N=C(\C)c1ccc(C)o1
InChIInChI=1S/C16H19NO2/c1-11-9-10-15(19-11)13(3)17-12(2)14-7-5-6-8-16(14)18-4/h5-10,12H,1-4H3/b17-13+
InChIKeyWGRMQMXRJOSKBC-GHRIWEEISA-N
XLogP4.17
TPSA34.73 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)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

2-methoxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]benzamide
CID 868019
1-(3-chlorobutan-2-yl)-2-methoxybenzene
CID 66470656
1-(2-methoxyphenyl)-N,N'-dimethylmethanediamine
CID 116954416
ethane;1-methoxy-2-propan-2-ylbenzene
CID 144548142
ethane;1-methoxy-2-propan-2-ylbenzene
CID 142030907
1-(2-methoxyphenyl)-2-(4-methylphenyl)ethanol
CID 15638774
(1S)-1-(2-methoxyphenyl)ethanethiol
CID 28974918
[(1S)-1-(2-methoxyphenyl)ethyl]phosphane
CID 130462203
(2Z)-2-[(Z)-1-(5-methylfuran-2-yl)ethylidenehydrazinylidene]-1,2-diphenylethanone
CID 7612621
(1R)-1-(2-methoxyphenyl)-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine
CID 11346678
(2-chlorophenyl)-(5-methylfuran-2-yl)methanol
CID 23912548
1-[(2S,3R)-3-deuteriobutan-2-yl]-2-methoxybenzene
CID 102007298

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanimine?
The IUPAC name of N-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanimine (CID 118868215) is N-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanimine.
What is the SMILES notation for N-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanimine?
The canonical SMILES for N-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanimine is COc1ccccc1C(C)/N=C(\C)c1ccc(C)o1.
What is the InChIKey of N-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanimine?
The InChIKey is WGRMQMXRJOSKBC-GHRIWEEISA-N. The full InChI is InChI=1S/C16H19NO2/c1-11-9-10-15(19-11)13(3)17-12(2)14-7-5-6-8-16(14)18-4/h5-10,12H,1-4H3/b17-13+.
What are the key properties of N-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanimine?
N-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanimine has a molecular weight of 257.33 g/mol, XLogP of 4.17, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanimine is sourced from PubChem (CID 118868215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).