N-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine

C15H13Cl2NO — CID 693665

IUPACN-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine
SMILESCCOc1ccc(/C=N/c2cc(Cl)cc(Cl)c2)cc1
InChIInChI=1S/C15H13Cl2NO/c1-2-19-15-5-3-11(4-6-15)10-18-14-8-12(16)7-13(17)9-14/h3-10H,2H2,1H3/b18-10+
InChIKeyKVOKIRRFKCYUDF-VCHYOVAHSA-N
MW294.18 g/mol
LogP5.14
Rot. Bonds4

About N-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine

N-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine (PubChem CID 693665) has the molecular formula C15H13Cl2NO and a molecular weight of 294.18 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine
PubChem CID693665
Molecular FormulaC15H13Cl2NO
Molecular Weight294.18 g/mol
Exact Mass293.04
IUPAC NameN-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine
SMILESCCOc1ccc(/C=N/c2cc(Cl)cc(Cl)c2)cc1
InChIInChI=1S/C15H13Cl2NO/c1-2-19-15-5-3-11(4-6-15)10-18-14-8-12(16)7-13(17)9-14/h3-10H,2H2,1H3/b18-10+
InChIKeyKVOKIRRFKCYUDF-VCHYOVAHSA-N
XLogP5.14
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.18
LogP ≤ 55.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(4-ethoxyphenyl)-N-phenylmethanimine
CID 555222
1-(4-ethoxyphenyl)-N-[4-[4-[(4-ethoxyphenyl)methylideneamino]phenoxy]phenyl]methanimine
CID 3287327
1-(4-ethoxyphenyl)-N-(4-methylphenyl)methanimine
CID 767226
1-(4-ethoxyphenyl)-N-(4-pentoxyphenyl)methanimine
CID 71354191
N-(4-chloro-3-nitrophenyl)-1-(4-ethoxyphenyl)methanimine
CID 767231
(3-chlorophenyl) 4-[(4-ethoxyphenyl)methylideneamino]benzoate
CID 101042830
1-(4-ethoxyphenyl)-N-(4-hexadecoxyphenyl)methanimine
CID 102390426
1-[4-[[4,6-bis[4-[(4-ethoxyphenyl)iminomethyl]phenoxy]-1,3,5-triazin-2-yl]oxy]phenyl]-N-(4-ethoxyphenyl)methanimine
CID 146036776
3-[(4-ethoxyphenyl)methylideneamino]benzonitrile
CID 613591
[2-chloro-4-[(4-ethoxyphenyl)iminomethyl]phenyl] 4-chlorobenzenesulfonate
CID 126222203
2-[(4-ethoxyphenyl)methylideneamino]fluoren-9-one
CID 821961
1-(4-ethoxyphenyl)-N-(4-hexylphenyl)methanimine
CID 4065401

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine?
The IUPAC name of N-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine (CID 693665) is N-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine.
What is the SMILES notation for N-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine?
The canonical SMILES for N-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine is CCOc1ccc(/C=N/c2cc(Cl)cc(Cl)c2)cc1.
What is the InChIKey of N-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine?
The InChIKey is KVOKIRRFKCYUDF-VCHYOVAHSA-N. The full InChI is InChI=1S/C15H13Cl2NO/c1-2-19-15-5-3-11(4-6-15)10-18-14-8-12(16)7-13(17)9-14/h3-10H,2H2,1H3/b18-10+.
What are the key properties of N-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine?
N-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine has a molecular weight of 294.18 g/mol, XLogP of 5.14, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)methanimine is sourced from PubChem (CID 693665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).