2-(4-ethoxyanilino)-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide

C19H23N3O2 — CID 5421665

IUPAC2-(4-ethoxyanilino)-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide
SMILESCCOc1ccc(NCC(=O)N/N=C(\C)c2ccc(C)cc2)cc1
InChIInChI=1S/C19H23N3O2/c1-4-24-18-11-9-17(10-12-18)20-13-19(23)22-21-15(3)16-7-5-14(2)6-8-16/h5-12,20H,4,13H2,1-3H3,(H,22,23)/b21-15+
InChIKeyQBPKADCLNVEXON-RCCKNPSSSA-N
MW325.41 g/mol
LogP3.35
Rot. Bonds7

About 2-(4-ethoxyanilino)-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide

2-(4-ethoxyanilino)-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide (PubChem CID 5421665) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 2-(4-ethoxyanilino)-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide.

Molecular Properties

Compound Name2-(4-ethoxyanilino)-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide
PubChem CID5421665
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name2-(4-ethoxyanilino)-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide
SMILESCCOc1ccc(NCC(=O)N/N=C(\C)c2ccc(C)cc2)cc1
InChIInChI=1S/C19H23N3O2/c1-4-24-18-11-9-17(10-12-18)20-13-19(23)22-21-15(3)16-7-5-14(2)6-8-16/h5-12,20H,4,13H2,1-3H3,(H,22,23)/b21-15+
InChIKeyQBPKADCLNVEXON-RCCKNPSSSA-N
XLogP3.35
TPSA62.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(4-ethoxyanilino)-N-[(E)-1-phenylethylideneamino]acetamide
CID 5421634
N-[(E)-1-(4-bromophenyl)ethylideneamino]-2-(4-methylanilino)acetamide
CID 5457542
N-[(Z)-1-(4-hydroxyphenyl)ethylideneamino]-2-(4-methoxyanilino)acetamide
CID 136742559
2-anilino-N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]acetamide
CID 7784236
[4-[N-[[2-(4-ethoxyanilino)-2-oxoacetyl]amino]-C-methylcarbonimidoyl]phenyl] 4-methylbenzoate
CID 5051283
2-(4-acetamidoanilino)-N-(4-ethoxyphenyl)acetamide
CID 54808313
N-[(Z)-1-(4-ethoxyphenyl)ethylideneamino]-2-phenylacetamide
CID 5399435
N-[(E)-1-(4-chlorophenyl)ethylideneamino]-2-(4-methylphenoxy)acetamide
CID 5398012
N-[1-(4-ethoxyphenyl)ethylideneamino]heptanamide
CID 3694468
N-[(E)-1-(3-aminophenyl)ethylideneamino]-2-(4-methylanilino)acetamide
CID 16553710
N-[(Z)-1-(4-ethylphenyl)ethylideneamino]-2-(4-fluoroanilino)acetamide
CID 5416891
N-[4-[[2-(4-ethoxyanilino)acetyl]amino]phenyl]propanamide
CID 54811266

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyanilino)-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide?
The IUPAC name of 2-(4-ethoxyanilino)-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide (CID 5421665) is 2-(4-ethoxyanilino)-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide.
What is the SMILES notation for 2-(4-ethoxyanilino)-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide?
The canonical SMILES for 2-(4-ethoxyanilino)-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide is CCOc1ccc(NCC(=O)N/N=C(\C)c2ccc(C)cc2)cc1.
What is the InChIKey of 2-(4-ethoxyanilino)-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide?
The InChIKey is QBPKADCLNVEXON-RCCKNPSSSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-4-24-18-11-9-17(10-12-18)20-13-19(23)22-21-15(3)16-7-5-14(2)6-8-16/h5-12,20H,4,13H2,1-3H3,(H,22,23)/b21-15+.
What are the key properties of 2-(4-ethoxyanilino)-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide?
2-(4-ethoxyanilino)-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide has a molecular weight of 325.41 g/mol, XLogP of 3.35, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyanilino)-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide is sourced from PubChem (CID 5421665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).