(2Z)-2-[(3-bromo-4-methoxyphenyl)methoxyimino]-N-(2,4-dimethylphenyl)acetamide

C18H19BrN2O3 — CID 9353788

IUPAC(2Z)-2-[(3-bromo-4-methoxyphenyl)methoxyimino]-N-(2,4-dimethylphenyl)acetamide
SMILESCOc1ccc(CO/N=C\C(=O)Nc2ccc(C)cc2C)cc1Br
InChIInChI=1S/C18H19BrN2O3/c1-12-4-6-16(13(2)8-12)21-18(22)10-20-24-11-14-5-7-17(23-3)15(19)9-14/h4-10H,11H2,1-3H3,(H,21,22)/b20-10-
InChIKeyODZAOEPXKCYDLI-JMIUGGIZSA-N
MW391.27 g/mol
LogP4.22
Rot. Bonds6

About (2Z)-2-[(3-bromo-4-methoxyphenyl)methoxyimino]-N-(2,4-dimethylphenyl)acetamide

(2Z)-2-[(3-bromo-4-methoxyphenyl)methoxyimino]-N-(2,4-dimethylphenyl)acetamide (PubChem CID 9353788) has the molecular formula C18H19BrN2O3 and a molecular weight of 391.27 g/mol. Its IUPAC name is (2Z)-2-[(3-bromo-4-methoxyphenyl)methoxyimino]-N-(2,4-dimethylphenyl)acetamide.

Molecular Properties

Compound Name(2Z)-2-[(3-bromo-4-methoxyphenyl)methoxyimino]-N-(2,4-dimethylphenyl)acetamide
PubChem CID9353788
Molecular FormulaC18H19BrN2O3
Molecular Weight391.27 g/mol
Exact Mass390.06
IUPAC Name(2Z)-2-[(3-bromo-4-methoxyphenyl)methoxyimino]-N-(2,4-dimethylphenyl)acetamide
SMILESCOc1ccc(CO/N=C\C(=O)Nc2ccc(C)cc2C)cc1Br
InChIInChI=1S/C18H19BrN2O3/c1-12-4-6-16(13(2)8-12)21-18(22)10-20-24-11-14-5-7-17(23-3)15(19)9-14/h4-10H,11H2,1-3H3,(H,21,22)/b20-10-
InChIKeyODZAOEPXKCYDLI-JMIUGGIZSA-N
XLogP4.22
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.27
LogP ≤ 54.22
H-Bond Donors ≤ 51
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

2-[(Z)-[2-(2,4-dimethylanilino)-2-oxoethylidene]amino]oxy-N-(2,4-dimethylphenyl)acetamide
CID 7665698
N-(4-chloro-2-methylphenyl)-2-[(Z)-[2-(2,4-dimethylanilino)-2-oxoethylidene]amino]oxyacetamide
CID 7665896
(2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide
CID 7666843
(2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide
CID 7666059
3-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]-N-(2,4-dimethylphenyl)prop-2-enamide
CID 2788733
2-[(Z)-[2-(2,4-dimethylanilino)-2-oxoethylidene]amino]oxy-N-(4-propan-2-ylphenyl)acetamide
CID 7665428
[(1R)-1-(3-bromo-4-methoxyphenyl)ethyl]-[2-(2,4-dimethylanilino)-2-oxoethyl]azanium
CID 9001137
N-(4-bromo-2-methylphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide
CID 108515633
N-(4-acetamido-3-methylphenyl)-3-(3-bromo-4-methoxyphenyl)propanamide
CID 38016381
(E)-3-(3,5-dimethoxy-4-phenylmethoxyphenyl)-N-(2,4-dimethylphenyl)prop-2-enamide
CID 11811804
N'-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylideneamino]-N-(2,4-dimethylphenyl)propanediamide
CID 135613448
N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-(2,4-dimethylphenyl)propanediamide
CID 108949721

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-[(3-bromo-4-methoxyphenyl)methoxyimino]-N-(2,4-dimethylphenyl)acetamide?
The IUPAC name of (2Z)-2-[(3-bromo-4-methoxyphenyl)methoxyimino]-N-(2,4-dimethylphenyl)acetamide (CID 9353788) is (2Z)-2-[(3-bromo-4-methoxyphenyl)methoxyimino]-N-(2,4-dimethylphenyl)acetamide.
What is the SMILES notation for (2Z)-2-[(3-bromo-4-methoxyphenyl)methoxyimino]-N-(2,4-dimethylphenyl)acetamide?
The canonical SMILES for (2Z)-2-[(3-bromo-4-methoxyphenyl)methoxyimino]-N-(2,4-dimethylphenyl)acetamide is COc1ccc(CO/N=C\C(=O)Nc2ccc(C)cc2C)cc1Br.
What is the InChIKey of (2Z)-2-[(3-bromo-4-methoxyphenyl)methoxyimino]-N-(2,4-dimethylphenyl)acetamide?
The InChIKey is ODZAOEPXKCYDLI-JMIUGGIZSA-N. The full InChI is InChI=1S/C18H19BrN2O3/c1-12-4-6-16(13(2)8-12)21-18(22)10-20-24-11-14-5-7-17(23-3)15(19)9-14/h4-10H,11H2,1-3H3,(H,21,22)/b20-10-.
What are the key properties of (2Z)-2-[(3-bromo-4-methoxyphenyl)methoxyimino]-N-(2,4-dimethylphenyl)acetamide?
(2Z)-2-[(3-bromo-4-methoxyphenyl)methoxyimino]-N-(2,4-dimethylphenyl)acetamide has a molecular weight of 391.27 g/mol, XLogP of 4.22, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-[(3-bromo-4-methoxyphenyl)methoxyimino]-N-(2,4-dimethylphenyl)acetamide is sourced from PubChem (CID 9353788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).