(2Z)-2-(2-ethylphenyl)-2-methoxyimino-N-methylacetamide

C12H16N2O2 — CID 22886048

IUPAC(2Z)-2-(2-ethylphenyl)-2-methoxyimino-N-methylacetamide
SMILESCCc1ccccc1/C(=N/OC)C(=O)NC
InChIInChI=1S/C12H16N2O2/c1-4-9-7-5-6-8-10(9)11(14-16-3)12(15)13-2/h5-8H,4H2,1-3H3,(H,13,15)/b14-11-
InChIKeyKNPXFSNBTQIQRS-KAMYIIQDSA-N
MW220.27 g/mol
LogP1.35
Rot. Bonds4

About (2Z)-2-(2-ethylphenyl)-2-methoxyimino-N-methylacetamide

(2Z)-2-(2-ethylphenyl)-2-methoxyimino-N-methylacetamide (PubChem CID 22886048) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is (2Z)-2-(2-ethylphenyl)-2-methoxyimino-N-methylacetamide.

Molecular Properties

Compound Name(2Z)-2-(2-ethylphenyl)-2-methoxyimino-N-methylacetamide
PubChem CID22886048
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name(2Z)-2-(2-ethylphenyl)-2-methoxyimino-N-methylacetamide
SMILESCCc1ccccc1/C(=N/OC)C(=O)NC
InChIInChI=1S/C12H16N2O2/c1-4-9-7-5-6-8-10(9)11(14-16-3)12(15)13-2/h5-8H,4H2,1-3H3,(H,13,15)/b14-11-
InChIKeyKNPXFSNBTQIQRS-KAMYIIQDSA-N
XLogP1.35
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

(2E)-2-methoxyimino-N-methyl-2-[2-(pyrimidin-2-yloxymethyl)phenyl]acetamide
CID 19429899
(2Z)-2-methoxyimino-N-methyl-2-[2-[(2-methylphenoxy)methyl]phenyl]acetamide
CID 15335383
(2Z)-2-[2-[(4-chloro-3-ethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide
CID 22419059
2-methoxyimino-N-methyl-2-[2-[2-(2-methylphenoxy)ethyl]phenyl]acetamide
CID 150692604
(2Z)-2-methoxyimino-N-methyl-2-[2-[(4-propan-2-yloxyphenoxy)methyl]phenyl]acetamide
CID 22419100
2-methoxyimino-2-[2-[[(3-methoxyimino-4-phenylbutan-2-ylidene)amino]oxymethyl]phenyl]-N-methylacetamide
CID 72611267
(2E)-2-methoxyimino-N-methyl-2-[2-[(4-prop-2-ynoxyphenoxy)methyl]phenyl]acetamide
CID 22419093
(2E)-2-[2-[(4-hydroxy-2-methylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide
CID 59898777
(2E)-2-methoxyimino-N-methyl-2-[2-[[(E)-1-(4-methylphenyl)ethylideneamino]oxymethyl]phenyl]acetamide
CID 157024287
2-[2-[[[(1Z)-1-(4-fluorophenyl)-1-methoxyiminobutan-2-ylidene]amino]oxymethyl]phenyl]-2-methoxyimino-N-methylacetamide
CID 59041141
(2E)-2-[2-[(3,5-dichloro-4-methoxyphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide
CID 87773755
(2E)-2-methoxyimino-N-methyl-2-[2-[(3-propan-2-yloxyphenoxy)methyl]phenyl]acetamide
CID 22847652

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-(2-ethylphenyl)-2-methoxyimino-N-methylacetamide?
The IUPAC name of (2Z)-2-(2-ethylphenyl)-2-methoxyimino-N-methylacetamide (CID 22886048) is (2Z)-2-(2-ethylphenyl)-2-methoxyimino-N-methylacetamide.
What is the SMILES notation for (2Z)-2-(2-ethylphenyl)-2-methoxyimino-N-methylacetamide?
The canonical SMILES for (2Z)-2-(2-ethylphenyl)-2-methoxyimino-N-methylacetamide is CCc1ccccc1/C(=N/OC)C(=O)NC.
What is the InChIKey of (2Z)-2-(2-ethylphenyl)-2-methoxyimino-N-methylacetamide?
The InChIKey is KNPXFSNBTQIQRS-KAMYIIQDSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-4-9-7-5-6-8-10(9)11(14-16-3)12(15)13-2/h5-8H,4H2,1-3H3,(H,13,15)/b14-11-.
What are the key properties of (2Z)-2-(2-ethylphenyl)-2-methoxyimino-N-methylacetamide?
(2Z)-2-(2-ethylphenyl)-2-methoxyimino-N-methylacetamide has a molecular weight of 220.27 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-(2-ethylphenyl)-2-methoxyimino-N-methylacetamide is sourced from PubChem (CID 22886048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).