N-(4-bromo-3-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine

C19H21BrN2O2 — CID 126227520

IUPACN-(4-bromo-3-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine
SMILESCOc1cc(N2CCOCC2)ccc1/C=N/c1ccc(Br)c(C)c1
InChIInChI=1S/C19H21BrN2O2/c1-14-11-16(4-6-18(14)20)21-13-15-3-5-17(12-19(15)23-2)22-7-9-24-10-8-22/h3-6,11-13H,7-10H2,1-2H3/b21-13+
InChIKeyOMYZDJJVACHTFD-FYJGNVAPSA-N
MW389.29 g/mol
LogP4.35
Rot. Bonds4

About N-(4-bromo-3-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine

N-(4-bromo-3-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine (PubChem CID 126227520) has the molecular formula C19H21BrN2O2 and a molecular weight of 389.29 g/mol. Its IUPAC name is N-(4-bromo-3-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine.

Molecular Properties

Compound NameN-(4-bromo-3-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine
PubChem CID126227520
Molecular FormulaC19H21BrN2O2
Molecular Weight389.29 g/mol
Exact Mass388.08
IUPAC NameN-(4-bromo-3-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine
SMILESCOc1cc(N2CCOCC2)ccc1/C=N/c1ccc(Br)c(C)c1
InChIInChI=1S/C19H21BrN2O2/c1-14-11-16(4-6-18(14)20)21-13-15-3-5-17(12-19(15)23-2)22-7-9-24-10-8-22/h3-6,11-13H,7-10H2,1-2H3/b21-13+
InChIKeyOMYZDJJVACHTFD-FYJGNVAPSA-N
XLogP4.35
TPSA34.06 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.29
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(2-methoxy-4-morpholin-4-ylphenyl)-N-(3-methylphenyl)methanimine
CID 126238269
N-(3-chloro-4-fluorophenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine
CID 126241546
N-(5-chloro-2-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine
CID 126246715
methyl 4-[(2-methoxy-4-morpholin-4-ylphenyl)methylideneamino]benzoate
CID 126245259
1-(2-methoxy-4-piperidin-1-ylphenyl)-N-(4-methylphenyl)methanimine
CID 126234630
1-(3,5-dibromo-4-methoxyphenyl)-N-(4-morpholin-4-ylphenyl)methanimine
CID 3296589
1-(2-methyl-4-morpholin-4-ylphenyl)-N-naphthalen-2-ylmethanimine
CID 126071092
4-bromo-3-[(4-morpholin-4-ylphenyl)iminomethyl]phenol
CID 5166404
2-methoxy-6-[(4-morpholin-4-ylphenyl)iminomethyl]phenol
CID 785168
4-[(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]phenol
CID 126239963
methyl 3-[(2-methoxy-4-morpholin-4-ylphenyl)methylideneamino]-2-methylbenzoate
CID 126245106
N-(2-bromophenyl)-1-(2-methyl-4-morpholin-4-ylphenyl)methanimine
CID 126075496

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-3-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine?
The IUPAC name of N-(4-bromo-3-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine (CID 126227520) is N-(4-bromo-3-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine.
What is the SMILES notation for N-(4-bromo-3-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine?
The canonical SMILES for N-(4-bromo-3-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine is COc1cc(N2CCOCC2)ccc1/C=N/c1ccc(Br)c(C)c1.
What is the InChIKey of N-(4-bromo-3-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine?
The InChIKey is OMYZDJJVACHTFD-FYJGNVAPSA-N. The full InChI is InChI=1S/C19H21BrN2O2/c1-14-11-16(4-6-18(14)20)21-13-15-3-5-17(12-19(15)23-2)22-7-9-24-10-8-22/h3-6,11-13H,7-10H2,1-2H3/b21-13+.
What are the key properties of N-(4-bromo-3-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine?
N-(4-bromo-3-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine has a molecular weight of 389.29 g/mol, XLogP of 4.35, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-3-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine is sourced from PubChem (CID 126227520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).