2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide

C19H23N3O2 — CID 6910847

IUPAC2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide
SMILESCOc1ccccc1NCC(=O)N/N=C/c1c(C)cc(C)cc1C
InChIInChI=1S/C19H23N3O2/c1-13-9-14(2)16(15(3)10-13)11-21-22-19(23)12-20-17-7-5-6-8-18(17)24-4/h5-11,20H,12H2,1-4H3,(H,22,23)/b21-11+
InChIKeyCOEBMOFPZVOMGT-SRZZPIQSSA-N
MW325.41 g/mol
LogP3.18
Rot. Bonds6

About 2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide

2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide (PubChem CID 6910847) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide.

Molecular Properties

Compound Name2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide
PubChem CID6910847
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide
SMILESCOc1ccccc1NCC(=O)N/N=C/c1c(C)cc(C)cc1C
InChIInChI=1S/C19H23N3O2/c1-13-9-14(2)16(15(3)10-13)11-21-22-19(23)12-20-17-7-5-6-8-18(17)24-4/h5-11,20H,12H2,1-4H3,(H,22,23)/b21-11+
InChIKeyCOEBMOFPZVOMGT-SRZZPIQSSA-N
XLogP3.18
TPSA62.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.18
H-Bond Donors ≤ 52
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-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethoxyphenyl)methylideneamino]acetamide
CID 6910859
2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide
CID 6910807
2-(2-methoxyanilino)-N-[(5-methylthiophen-2-yl)methylideneamino]acetamide
CID 968305
N-[(Z)-(4-hydroxy-3,5-diiodophenyl)methylideneamino]-2-(2-methoxyanilino)acetamide
CID 171985531
N-[(Z)-(2-fluorophenyl)methylideneamino]-2-(2-methoxyanilino)acetamide
CID 5404184
N-[(Z)-(3-fluoro-4-methoxyphenyl)methylideneamino]-2-(2-methoxyanilino)acetamide
CID 8974942
2-(2,5-dimethylanilino)-N-(2-methoxyphenyl)acetamide
CID 9079653
[2,6-dimethoxy-4-[(Z)-[[2-(2-methoxyanilino)acetyl]hydrazinylidene]methyl]phenyl] acetate
CID 7933428
N-[(Z)-(2-hydroxy-3-methoxyphenyl)methylideneamino]-2-(2-methylanilino)acetamide
CID 135541691
2-(2,4-dimethylanilino)-N-[(Z)-(2-hydroxy-3-methoxyphenyl)methylideneamino]acetamide
CID 136899302
N-[(E)-[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylideneamino]-2-(2-methoxyanilino)acetamide
CID 135852673
N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]-2-(2-methylanilino)acetamide
CID 6277132

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide?
The IUPAC name of 2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide (CID 6910847) is 2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide.
What is the SMILES notation for 2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide?
The canonical SMILES for 2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide is COc1ccccc1NCC(=O)N/N=C/c1c(C)cc(C)cc1C.
What is the InChIKey of 2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide?
The InChIKey is COEBMOFPZVOMGT-SRZZPIQSSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-13-9-14(2)16(15(3)10-13)11-21-22-19(23)12-20-17-7-5-6-8-18(17)24-4/h5-11,20H,12H2,1-4H3,(H,22,23)/b21-11+.
What are the key properties of 2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide?
2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide has a molecular weight of 325.41 g/mol, XLogP of 3.18, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide is sourced from PubChem (CID 6910847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).