1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(4-ethoxyphenyl)methanimine

C19H15Cl2NO2 — CID 3098706

IUPAC1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(4-ethoxyphenyl)methanimine
SMILESCCOc1ccc(/N=C/c2ccc(-c3ccc(Cl)cc3Cl)o2)cc1
InChIInChI=1S/C19H15Cl2NO2/c1-2-23-15-6-4-14(5-7-15)22-12-16-8-10-19(24-16)17-9-3-13(20)11-18(17)21/h3-12H,2H2,1H3/b22-12+
InChIKeyQIOKHDPULBPMQQ-WSDLNYQXSA-N
MW360.24 g/mol
LogP6.40
Rot. Bonds5

About 1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(4-ethoxyphenyl)methanimine

1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(4-ethoxyphenyl)methanimine (PubChem CID 3098706) has the molecular formula C19H15Cl2NO2 and a molecular weight of 360.24 g/mol. Its IUPAC name is 1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(4-ethoxyphenyl)methanimine.

Molecular Properties

Compound Name1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(4-ethoxyphenyl)methanimine
PubChem CID3098706
Molecular FormulaC19H15Cl2NO2
Molecular Weight360.24 g/mol
Exact Mass359.05
IUPAC Name1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(4-ethoxyphenyl)methanimine
SMILESCCOc1ccc(/N=C/c2ccc(-c3ccc(Cl)cc3Cl)o2)cc1
InChIInChI=1S/C19H15Cl2NO2/c1-2-23-15-6-4-14(5-7-15)22-12-16-8-10-19(24-16)17-9-3-13(20)11-18(17)21/h3-12H,2H2,1H3/b22-12+
InChIKeyQIOKHDPULBPMQQ-WSDLNYQXSA-N
XLogP6.40
TPSA34.73 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.24
LogP ≤ 56.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[[5-(2,4-dichlorophenyl)furan-2-yl]methylidene]hydroxylamine
CID 73164714
N-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine
CID 693665
(2S)-2-[[2-(4-chlorophenoxy)acetyl]amino]-N-[(Z)-[5-(2,4-dichlorophenyl)furan-2-yl]methylideneamino]-4-methylpentanamide
CID 126026692
N-[(Z)-[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylideneamino]-4-ethoxybenzamide
CID 9215198
1-(4-ethoxyphenyl)-N-[4-[4-[(4-ethoxyphenyl)methylideneamino]phenoxy]phenyl]methanimine
CID 3287327
1-(4-chlorophenyl)-N-[4-[(2,4-dichlorophenyl)methoxy]phenyl]methanimine
CID 3137142
1-(4-ethoxyphenyl)-N-(4-methylphenyl)methanimine
CID 767226
5-[5-(2,4-dichlorophenyl)furan-2-yl]-1-(4-ethoxyphenyl)-4-pyridin-2-ylimidazolidine-2-thione
CID 133156241
(5E)-5-[[5-(2,5-dichlorophenyl)furan-2-yl]methylidene]-3-(4-ethoxyphenyl)-1,3-thiazolidine-2,4-dione
CID 18839692
N-[(Z)-[5-(2,4-dichlorophenyl)furan-2-yl]methylideneamino]-1-(3,4-dimethoxyphenyl)methanamine
CID 92658221
(3-chlorophenyl) 4-[(4-ethoxyphenyl)methylideneamino]benzoate
CID 101042830
1-(4-ethoxyphenyl)-N-phenylmethanimine
CID 555222

Frequently Asked Questions

What is the IUPAC name of 1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(4-ethoxyphenyl)methanimine?
The IUPAC name of 1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(4-ethoxyphenyl)methanimine (CID 3098706) is 1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(4-ethoxyphenyl)methanimine.
What is the SMILES notation for 1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(4-ethoxyphenyl)methanimine?
The canonical SMILES for 1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(4-ethoxyphenyl)methanimine is CCOc1ccc(/N=C/c2ccc(-c3ccc(Cl)cc3Cl)o2)cc1.
What is the InChIKey of 1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(4-ethoxyphenyl)methanimine?
The InChIKey is QIOKHDPULBPMQQ-WSDLNYQXSA-N. The full InChI is InChI=1S/C19H15Cl2NO2/c1-2-23-15-6-4-14(5-7-15)22-12-16-8-10-19(24-16)17-9-3-13(20)11-18(17)21/h3-12H,2H2,1H3/b22-12+.
What are the key properties of 1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(4-ethoxyphenyl)methanimine?
1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(4-ethoxyphenyl)methanimine has a molecular weight of 360.24 g/mol, XLogP of 6.40, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(4-ethoxyphenyl)methanimine is sourced from PubChem (CID 3098706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).