N-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide

C19H22N2O3 — CID 4224310

IUPACN-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide
SMILESCCc1ccc(C(C)=NNC(=O)c2ccc(OC)cc2OC)cc1
InChIInChI=1S/C19H22N2O3/c1-5-14-6-8-15(9-7-14)13(2)20-21-19(22)17-11-10-16(23-3)12-18(17)24-4/h6-12H,5H2,1-4H3,(H,21,22)
InChIKeyGASDMBURBPQOOD-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.42
Rot. Bonds6

About N-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide

N-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide (PubChem CID 4224310) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide
PubChem CID4224310
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide
SMILESCCc1ccc(C(C)=NNC(=O)c2ccc(OC)cc2OC)cc1
InChIInChI=1S/C19H22N2O3/c1-5-14-6-8-15(9-7-14)13(2)20-21-19(22)17-11-10-16(23-3)12-18(17)24-4/h6-12H,5H2,1-4H3,(H,21,22)
InChIKeyGASDMBURBPQOOD-UHFFFAOYSA-N
XLogP3.42
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.42
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

2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide
CID 873053
N-[[4-(4-ethylanilino)-4-oxobutan-2-ylidene]amino]-2,4-dimethoxybenzamide
CID 3399495
2,4-dimethoxy-N-[(Z)-1-[4-[(2-phenylacetyl)amino]phenyl]ethylideneamino]benzamide
CID 26871625
N-[1-(4-ethylphenyl)ethylideneamino]-2-(4-methoxyphenyl)acetamide
CID 4247577
N-[1-(2,4-dimethoxyphenyl)ethylideneamino]-4-fluorobenzamide
CID 78596498
N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]-3,4,5-triethoxybenzamide
CID 22830699
N-[1-(2,4-dimethoxyphenyl)ethylideneamino]-4-hexoxybenzamide
CID 4930636
N-[1-(2,4-dimethoxyphenyl)ethylideneamino]-2-prop-2-enoxybenzamide
CID 4928995
4-(butanoylamino)-N-[1-(2,4-dimethoxyphenyl)ethylideneamino]benzamide
CID 3380721
4-amino-N-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]benzamide;oxalic acid
CID 163326318
2-hydroxy-4-methoxy-N-[(Z)-1-phenylethylideneamino]benzamide
CID 126396445
2,4-dichloro-N-[1-(2,4-dimethoxyphenyl)ethylideneamino]benzamide
CID 4507808

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide?
The IUPAC name of N-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide (CID 4224310) is N-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide.
What is the SMILES notation for N-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide?
The canonical SMILES for N-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide is CCc1ccc(C(C)=NNC(=O)c2ccc(OC)cc2OC)cc1.
What is the InChIKey of N-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide?
The InChIKey is GASDMBURBPQOOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-5-14-6-8-15(9-7-14)13(2)20-21-19(22)17-11-10-16(23-3)12-18(17)24-4/h6-12H,5H2,1-4H3,(H,21,22).
What are the key properties of N-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide?
N-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide has a molecular weight of 326.40 g/mol, XLogP of 3.42, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide is sourced from PubChem (CID 4224310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).