2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide

C17H19N3O3 — CID 6910807

IUPAC2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide
SMILESCOc1ccc(/C=N/NC(=O)CNc2ccccc2OC)cc1
InChIInChI=1S/C17H19N3O3/c1-22-14-9-7-13(8-10-14)11-19-20-17(21)12-18-15-5-3-4-6-16(15)23-2/h3-11,18H,12H2,1-2H3,(H,20,21)/b19-11+
InChIKeyDPACHJBZYVMVRE-YBFXNURJSA-N
MW313.36 g/mol
LogP2.27
Rot. Bonds7

About 2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide

2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide (PubChem CID 6910807) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is 2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide.

Molecular Properties

Compound Name2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide
PubChem CID6910807
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC Name2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide
SMILESCOc1ccc(/C=N/NC(=O)CNc2ccccc2OC)cc1
InChIInChI=1S/C17H19N3O3/c1-22-14-9-7-13(8-10-14)11-19-20-17(21)12-18-15-5-3-4-6-16(15)23-2/h3-11,18H,12H2,1-2H3,(H,20,21)/b19-11+
InChIKeyDPACHJBZYVMVRE-YBFXNURJSA-N
XLogP2.27
TPSA71.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

N-[(Z)-(4-ethoxyphenyl)methylideneamino]-2-(2-methoxyanilino)acetamide
CID 5401700
N-[(4-ethoxyphenyl)methylideneamino]-2-(2-methoxyanilino)acetamide
CID 759194
N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-2-(2-methoxyanilino)acetamide
CID 6910799
2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethoxyphenyl)methylideneamino]acetamide
CID 6910859
N-[(Z)-(3-fluoro-4-methoxyphenyl)methylideneamino]-2-(2-methoxyanilino)acetamide
CID 8974942
N-[(Z)-(4-hydroxy-3,5-diiodophenyl)methylideneamino]-2-(2-methoxyanilino)acetamide
CID 171985531
[4-[[[2-(2-methoxyanilino)acetyl]hydrazinylidene]methyl]phenyl] 3-fluorobenzoate
CID 1118922
2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide
CID 717684
[2,6-dimethoxy-4-[(Z)-[[2-(2-methoxyanilino)acetyl]hydrazinylidene]methyl]phenyl] acetate
CID 7933428
N-[(Z)-(4-hydroxyphenyl)methylideneamino]-2-(4-methoxyanilino)acetamide
CID 136899311
N-[(E)-(4-methoxyphenyl)methylideneamino]-N'-[(Z)-(4-methoxyphenyl)methylideneamino]propanediamide
CID 44726282
2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide
CID 6910847

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide?
The IUPAC name of 2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide (CID 6910807) is 2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide.
What is the SMILES notation for 2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide?
The canonical SMILES for 2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide is COc1ccc(/C=N/NC(=O)CNc2ccccc2OC)cc1.
What is the InChIKey of 2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide?
The InChIKey is DPACHJBZYVMVRE-YBFXNURJSA-N. The full InChI is InChI=1S/C17H19N3O3/c1-22-14-9-7-13(8-10-14)11-19-20-17(21)12-18-15-5-3-4-6-16(15)23-2/h3-11,18H,12H2,1-2H3,(H,20,21)/b19-11+.
What are the key properties of 2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide?
2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide has a molecular weight of 313.36 g/mol, XLogP of 2.27, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide is sourced from PubChem (CID 6910807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).