(Z)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-2-imidazol-1-ylethanimine

C18H15Cl2N3O — CID 88721100

IUPAC(Z)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-2-imidazol-1-ylethanimine
SMILESClc1ccc(CO/N=C(\Cn2ccnc2)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C18H15Cl2N3O/c19-16-5-1-14(2-6-16)12-24-22-18(11-23-10-9-21-13-23)15-3-7-17(20)8-4-15/h1-10,13H,11-12H2/b22-18+
InChIKeyNJBADHBPMLRHIQ-RELWKKBWSA-N
MW360.24 g/mol
LogP4.81
Rot. Bonds6

About (Z)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-2-imidazol-1-ylethanimine

(Z)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-2-imidazol-1-ylethanimine (PubChem CID 88721100) has the molecular formula C18H15Cl2N3O and a molecular weight of 360.24 g/mol. Its IUPAC name is (Z)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-2-imidazol-1-ylethanimine.

Molecular Properties

Compound Name(Z)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-2-imidazol-1-ylethanimine
PubChem CID88721100
Molecular FormulaC18H15Cl2N3O
Molecular Weight360.24 g/mol
Exact Mass359.06
IUPAC Name(Z)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-2-imidazol-1-ylethanimine
SMILESClc1ccc(CO/N=C(\Cn2ccnc2)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C18H15Cl2N3O/c19-16-5-1-14(2-6-16)12-24-22-18(11-23-10-9-21-13-23)15-3-7-17(20)8-4-15/h1-10,13H,11-12H2/b22-18+
InChIKeyNJBADHBPMLRHIQ-RELWKKBWSA-N
XLogP4.81
TPSA39.41 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.24
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[4-[2-(4-chlorophenyl)ethynyl]phenyl]-N-ethoxy-2-imidazol-1-ylethanimine
CID 123807521
1-[2-(4-chlorophenyl)prop-2-enyl]imidazole
CID 71322821
N-[(2-fluorophenyl)methoxy]-2-imidazol-1-yl-1-[4-(2-phenylethynyl)phenyl]ethanimine
CID 123991001
azonic acid;1-(2,4-dichlorophenyl)-N-[(2,4-dichlorophenyl)methoxy]-2-imidazol-1-ylethanimine
CID 159230946
1-[4-(2-cyclopropylethynyl)-3,5-difluorophenyl]-2-imidazol-1-yl-N-phenylmethoxyethanimine
CID 123764054
acetic acid;(Z)-1-(2,4-dichlorophenyl)-N-[(2,4-dichlorophenyl)methoxy]-2-imidazol-1-ylethanimine
CID 129184950
(E)-N-[[2-(4-chlorophenyl)-2-methyl-1,3-dioxolan-4-yl]methoxy]-2-imidazol-1-yl-1-phenylethanimine
CID 6482197
1-[2-(4-chlorophenyl)-2-[(4-chlorophenyl)methoxy]ethyl]imidazole
CID 21443191
1-(2,4-dichlorophenyl)-2-imidazol-1-yl-N-prop-1-enoxyethanimine
CID 141174032
(4-hydroxyphenyl)-[4-(imidazol-1-ylmethyl)phenyl]methanone
CID 171357643
1-[4-(2,4-dichlorophenyl)phenyl]-2-imidazol-1-ylethanone
CID 57320594
(E)-N-[(4-chlorophenyl)methoxy]-1-pyrimidin-5-ylethanimine
CID 142638631

Frequently Asked Questions

What is the IUPAC name of (Z)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-2-imidazol-1-ylethanimine?
The IUPAC name of (Z)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-2-imidazol-1-ylethanimine (CID 88721100) is (Z)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-2-imidazol-1-ylethanimine.
What is the SMILES notation for (Z)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-2-imidazol-1-ylethanimine?
The canonical SMILES for (Z)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-2-imidazol-1-ylethanimine is Clc1ccc(CO/N=C(\Cn2ccnc2)c2ccc(Cl)cc2)cc1.
What is the InChIKey of (Z)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-2-imidazol-1-ylethanimine?
The InChIKey is NJBADHBPMLRHIQ-RELWKKBWSA-N. The full InChI is InChI=1S/C18H15Cl2N3O/c19-16-5-1-14(2-6-16)12-24-22-18(11-23-10-9-21-13-23)15-3-7-17(20)8-4-15/h1-10,13H,11-12H2/b22-18+.
What are the key properties of (Z)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-2-imidazol-1-ylethanimine?
(Z)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-2-imidazol-1-ylethanimine has a molecular weight of 360.24 g/mol, XLogP of 4.81, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-2-imidazol-1-ylethanimine is sourced from PubChem (CID 88721100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).