N-(5-chloro-2-methylphenyl)-1-[4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl]methanimine

C22H18Cl2N2 — CID 3304747

IUPACN-(5-chloro-2-methylphenyl)-1-[4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl]methanimine
SMILESCc1ccc(Cl)cc1/N=C/c1ccc(/C=N/c2cc(Cl)ccc2C)cc1
InChIInChI=1S/C22H18Cl2N2/c1-15-3-9-19(23)11-21(15)25-13-17-5-7-18(8-6-17)14-26-22-12-20(24)10-4-16(22)2/h3-14H,1-2H3/b25-13+,26-14+
InChIKeyRGZJKAWVLJWUBF-BKHCZYBLSA-N
MW381.31 g/mol
LogP7.11
Rot. Bonds4

About N-(5-chloro-2-methylphenyl)-1-[4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl]methanimine

N-(5-chloro-2-methylphenyl)-1-[4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl]methanimine (PubChem CID 3304747) has the molecular formula C22H18Cl2N2 and a molecular weight of 381.31 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-1-[4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl]methanimine.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-1-[4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl]methanimine
PubChem CID3304747
Molecular FormulaC22H18Cl2N2
Molecular Weight381.31 g/mol
Exact Mass380.08
IUPAC NameN-(5-chloro-2-methylphenyl)-1-[4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl]methanimine
SMILESCc1ccc(Cl)cc1/N=C/c1ccc(/C=N/c2cc(Cl)ccc2C)cc1
InChIInChI=1S/C22H18Cl2N2/c1-15-3-9-19(23)11-21(15)25-13-17-5-7-18(8-6-17)14-26-22-12-20(24)10-4-16(22)2/h3-14H,1-2H3/b25-13+,26-14+
InChIKeyRGZJKAWVLJWUBF-BKHCZYBLSA-N
XLogP7.11
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.31
LogP ≤ 57.11
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

4-[(5-chloro-2-methylphenyl)iminomethyl]-N,N-diethylaniline
CID 21210007
N-(5-chloro-2-methylphenyl)-1-(1-methylpyrrol-3-yl)methanimine
CID 50854031
3-[(5-chloro-2-methylphenyl)iminomethyl]phenol
CID 126216051
N-(2,5-dimethylphenyl)-1-[4-[(2,5-dimethylphenyl)iminomethyl]phenyl]methanimine
CID 134109201
N-(5-chloro-2-methylphenyl)-1-[4-[(2,4-dichlorophenyl)methoxy]phenyl]methanimine
CID 126217320
N-(5-chloro-2-methylphenyl)-1-[4-[(2-chlorophenyl)methoxy]phenyl]methanimine
CID 126206758
N-(5-chloro-2-methylphenyl)-1-(2-chlorophenyl)methanimine
CID 4191286
N-(5-chloro-2-methylphenyl)-1-[4-(2,4-dinitrophenoxy)phenyl]methanimine
CID 126209083
N-(5-chloro-2-methylphenyl)-1-[3,5-dibromo-4-[(3-chlorophenyl)methoxy]phenyl]methanimine
CID 126220024
1-[4-(4-chlorophenyl)sulfanylphenyl]-N-(2-methylphenyl)methanimine
CID 126107382
N-(5-chloro-2-methylphenyl)-1-(1-ethyl-2,2,4-trimethylquinolin-6-yl)methanimine
CID 50866316
[2-bromo-4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl] benzenesulfonate
CID 126221621

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-1-[4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl]methanimine?
The IUPAC name of N-(5-chloro-2-methylphenyl)-1-[4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl]methanimine (CID 3304747) is N-(5-chloro-2-methylphenyl)-1-[4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl]methanimine.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-1-[4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl]methanimine?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-1-[4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl]methanimine is Cc1ccc(Cl)cc1/N=C/c1ccc(/C=N/c2cc(Cl)ccc2C)cc1.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-1-[4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl]methanimine?
The InChIKey is RGZJKAWVLJWUBF-BKHCZYBLSA-N. The full InChI is InChI=1S/C22H18Cl2N2/c1-15-3-9-19(23)11-21(15)25-13-17-5-7-18(8-6-17)14-26-22-12-20(24)10-4-16(22)2/h3-14H,1-2H3/b25-13+,26-14+.
What are the key properties of N-(5-chloro-2-methylphenyl)-1-[4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl]methanimine?
N-(5-chloro-2-methylphenyl)-1-[4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl]methanimine has a molecular weight of 381.31 g/mol, XLogP of 7.11, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-1-[4-[(5-chloro-2-methylphenyl)iminomethyl]phenyl]methanimine is sourced from PubChem (CID 3304747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).