2-(3-methylphenoxy)-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]acetamide

C20H24N2O3 — CID 7934604

IUPAC2-(3-methylphenoxy)-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]acetamide
SMILESCCCOc1ccc(/C(C)=N\NC(=O)COc2cccc(C)c2)cc1
InChIInChI=1S/C20H24N2O3/c1-4-12-24-18-10-8-17(9-11-18)16(3)21-22-20(23)14-25-19-7-5-6-15(2)13-19/h5-11,13H,4,12,14H2,1-3H3,(H,22,23)/b21-16-
InChIKeyJMYBUNBNEPPJHO-PGMHBOJBSA-N
MW340.42 g/mol
LogP3.70
Rot. Bonds8

About 2-(3-methylphenoxy)-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]acetamide

2-(3-methylphenoxy)-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]acetamide (PubChem CID 7934604) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 2-(3-methylphenoxy)-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]acetamide.

Molecular Properties

Compound Name2-(3-methylphenoxy)-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]acetamide
PubChem CID7934604
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name2-(3-methylphenoxy)-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]acetamide
SMILESCCCOc1ccc(/C(C)=N\NC(=O)COc2cccc(C)c2)cc1
InChIInChI=1S/C20H24N2O3/c1-4-12-24-18-10-8-17(9-11-18)16(3)21-22-20(23)14-25-19-7-5-6-15(2)13-19/h5-11,13H,4,12,14H2,1-3H3,(H,22,23)/b21-16-
InChIKeyJMYBUNBNEPPJHO-PGMHBOJBSA-N
XLogP3.70
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.70
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-(3-methylphenoxy)-N-[1-(4-methylphenyl)ethylideneamino]acetamide
CID 968545
N-[1-(4-hydroxyphenyl)ethylideneamino]-2-(3-methylphenoxy)acetamide
CID 969299
N-[(Z)-1-(4-tert-butylphenyl)ethylideneamino]-2-(3-methylphenoxy)acetamide
CID 6938758
N-[(E)-1-(3-methylphenyl)ethylideneamino]-2-phenoxyacetamide
CID 19685184
N-[1-(1,3-benzodioxol-5-yl)ethylideneamino]-2-(3-methylphenoxy)acetamide
CID 4657371
2-phenoxy-N-(1-phenylethylideneamino)acetamide
CID 3448907
2-[4-[(Z)-N-[[2-(3-fluorophenoxy)acetyl]amino]-C-methylcarbonimidoyl]phenoxy]acetic acid
CID 9240177
2-(3-methylphenoxy)-N-[(Z)-1-[4-(2-oxopyrrolidin-1-yl)phenyl]ethylideneamino]acetamide
CID 8979018
2-(3-chlorophenoxy)-N-[(E)-1-(4-chlorophenyl)ethylideneamino]acetamide
CID 6920998
2-(3-chlorophenoxy)-N-[1-(4-chlorophenyl)ethylideneamino]acetamide
CID 683722
2-(3-bromophenoxy)-N-[1-(4-bromophenyl)ethylideneamino]acetamide
CID 1124773
propyl 4-[2-[2-[1-(3-aminophenyl)ethylidene]hydrazinyl]-2-oxoethoxy]benzoate
CID 4927512

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenoxy)-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]acetamide?
The IUPAC name of 2-(3-methylphenoxy)-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]acetamide (CID 7934604) is 2-(3-methylphenoxy)-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]acetamide.
What is the SMILES notation for 2-(3-methylphenoxy)-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]acetamide?
The canonical SMILES for 2-(3-methylphenoxy)-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]acetamide is CCCOc1ccc(/C(C)=N\NC(=O)COc2cccc(C)c2)cc1.
What is the InChIKey of 2-(3-methylphenoxy)-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]acetamide?
The InChIKey is JMYBUNBNEPPJHO-PGMHBOJBSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-4-12-24-18-10-8-17(9-11-18)16(3)21-22-20(23)14-25-19-7-5-6-15(2)13-19/h5-11,13H,4,12,14H2,1-3H3,(H,22,23)/b21-16-.
What are the key properties of 2-(3-methylphenoxy)-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]acetamide?
2-(3-methylphenoxy)-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]acetamide has a molecular weight of 340.42 g/mol, XLogP of 3.70, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenoxy)-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]acetamide is sourced from PubChem (CID 7934604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).