(2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide

C18H19FN2O3 — CID 7666059

IUPAC(2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide
SMILESCc1ccc(NC(=O)/C=N\OCCOc2ccc(F)cc2)c(C)c1
InChIInChI=1S/C18H19FN2O3/c1-13-3-8-17(14(2)11-13)21-18(22)12-20-24-10-9-23-16-6-4-15(19)5-7-16/h3-8,11-12H,9-10H2,1-2H3,(H,21,22)/b20-12-
InChIKeyUGSZSXNBROEKDQ-NDENLUEZSA-N
MW330.36 g/mol
LogP3.46
Rot. Bonds7

About (2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide

(2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide (PubChem CID 7666059) has the molecular formula C18H19FN2O3 and a molecular weight of 330.36 g/mol. Its IUPAC name is (2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide.

Molecular Properties

Compound Name(2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide
PubChem CID7666059
Molecular FormulaC18H19FN2O3
Molecular Weight330.36 g/mol
Exact Mass330.14
IUPAC Name(2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide
SMILESCc1ccc(NC(=O)/C=N\OCCOc2ccc(F)cc2)c(C)c1
InChIInChI=1S/C18H19FN2O3/c1-13-3-8-17(14(2)11-13)21-18(22)12-20-24-10-9-23-16-6-4-15(19)5-7-16/h3-8,11-12H,9-10H2,1-2H3,(H,21,22)/b20-12-
InChIKeyUGSZSXNBROEKDQ-NDENLUEZSA-N
XLogP3.46
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.36
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide?
The IUPAC name of (2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide (CID 7666059) is (2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide.
What is the SMILES notation for (2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide?
The canonical SMILES for (2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide is Cc1ccc(NC(=O)/C=N\OCCOc2ccc(F)cc2)c(C)c1.
What is the InChIKey of (2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide?
The InChIKey is UGSZSXNBROEKDQ-NDENLUEZSA-N. The full InChI is InChI=1S/C18H19FN2O3/c1-13-3-8-17(14(2)11-13)21-18(22)12-20-24-10-9-23-16-6-4-15(19)5-7-16/h3-8,11-12H,9-10H2,1-2H3,(H,21,22)/b20-12-.
What are the key properties of (2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide?
(2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide has a molecular weight of 330.36 g/mol, XLogP of 3.46, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-N-(2,4-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethoxyimino]acetamide is sourced from PubChem (CID 7666059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).