N-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)methanimine

C13H13NO2 — CID 681311

IUPACN-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)methanimine
SMILESCOc1ccc(/N=C/c2ccc(C)o2)cc1
InChIInChI=1S/C13H13NO2/c1-10-3-6-13(16-10)9-14-11-4-7-12(15-2)8-5-11/h3-9H,1-2H3/b14-9+
InChIKeyQVEPAXZWXQSIRS-NTEUORMPSA-N
MW215.25 g/mol
LogP3.35
Rot. Bonds3

About N-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)methanimine

N-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)methanimine (PubChem CID 681311) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)methanimine.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)methanimine
PubChem CID681311
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC NameN-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)methanimine
SMILESCOc1ccc(/N=C/c2ccc(C)o2)cc1
InChIInChI=1S/C13H13NO2/c1-10-3-6-13(16-10)9-14-11-4-7-12(15-2)8-5-11/h3-9H,1-2H3/b14-9+
InChIKeyQVEPAXZWXQSIRS-NTEUORMPSA-N
XLogP3.35
TPSA34.73 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)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

N-(Furfurylidene)-P-anisidine
CID 778756
Aniline, N-(5-nitrofurfurylidene)-
CID 9077
N-Furfurylidene-M-toluidine
CID 5046711
4-(furan-2-ylmethylideneamino)-N,N-dimethylaniline
CID 781698
N,N-dimethyl-4-[(5-methylfuran-2-yl)methylideneamino]aniline
CID 781700
1-(furan-2-yl)-N-(4-methoxyphenyl)methanimine oxide
CID 11183543
(Z)-2-methyl-N-((5-methylfuran-2-yl)methylene)aniline oxide
CID 5890581
4-((1E)-2-(2-furyl)-1-azavinyl)phenol
CID 674723
p-Phenylenediamine, N,N'-difurfurylidene-
CID 99740
4-Methoxy-N-((5-phenyl-2-furyl)methylene)aniline
CID 681807
1-(furan-2-yl)-N-phenylmethanimine oxide
CID 1585019
1-(furan-3-yl)-N-(4-methoxyphenyl)methanimine oxide
CID 42628304

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)methanimine?
The IUPAC name of N-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)methanimine (CID 681311) is N-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)methanimine.
What is the SMILES notation for N-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)methanimine?
The canonical SMILES for N-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)methanimine is COc1ccc(/N=C/c2ccc(C)o2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)methanimine?
The InChIKey is QVEPAXZWXQSIRS-NTEUORMPSA-N. The full InChI is InChI=1S/C13H13NO2/c1-10-3-6-13(16-10)9-14-11-4-7-12(15-2)8-5-11/h3-9H,1-2H3/b14-9+.
What are the key properties of N-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)methanimine?
N-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)methanimine has a molecular weight of 215.25 g/mol, XLogP of 3.35, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-1-(5-methylfuran-2-yl)methanimine is sourced from PubChem (CID 681311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).