2-(4-ethylphenoxy)-N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]acetamide

C19H22N2O3 — CID 135575983

IUPAC2-(4-ethylphenoxy)-N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]acetamide
SMILESCCc1ccc(OCC(=O)N/N=C(\C)c2cc(C)ccc2O)cc1
InChIInChI=1S/C19H22N2O3/c1-4-15-6-8-16(9-7-15)24-12-19(23)21-20-14(3)17-11-13(2)5-10-18(17)22/h5-11,22H,4,12H2,1-3H3,(H,21,23)/b20-14+
InChIKeyRNSDCFBRZFFAKF-XSFVSMFZSA-N
MW326.40 g/mol
LogP3.18
Rot. Bonds6

About 2-(4-ethylphenoxy)-N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]acetamide

2-(4-ethylphenoxy)-N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]acetamide (PubChem CID 135575983) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 2-(4-ethylphenoxy)-N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]acetamide.

Molecular Properties

Compound Name2-(4-ethylphenoxy)-N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]acetamide
PubChem CID135575983
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name2-(4-ethylphenoxy)-N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]acetamide
SMILESCCc1ccc(OCC(=O)N/N=C(\C)c2cc(C)ccc2O)cc1
InChIInChI=1S/C19H22N2O3/c1-4-15-6-8-16(9-7-15)24-12-19(23)21-20-14(3)17-11-13(2)5-10-18(17)22/h5-11,22H,4,12H2,1-3H3,(H,21,23)/b20-14+
InChIKeyRNSDCFBRZFFAKF-XSFVSMFZSA-N
XLogP3.18
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', '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-(3,5-dimethylphenoxy)-N-[(E)-1-(5-fluoro-2-hydroxyphenyl)ethylideneamino]acetamide
CID 135674748
N-[(E)-1-(5-fluoro-2-hydroxyphenyl)ethylideneamino]-2-(3-methylphenoxy)acetamide
CID 135828355
2-(4-ethylphenoxy)-N-[(E)-1-(5-fluoro-2-hydroxyphenyl)propylideneamino]acetamide
CID 135575981
2-(4-ethylphenoxy)-N-(1-phenylethylideneamino)acetamide
CID 905266
2-(4-chlorophenoxy)-N-[1-(2,4-dimethylphenyl)ethylideneamino]acetamide
CID 4146329
N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]-4-propoxybenzamide
CID 137268526
2-(2-bromo-4-ethylphenoxy)-N-[1-(2,5-dihydroxyphenyl)ethylideneamino]acetamide
CID 165341936
N-[1-(2-hydroxyphenyl)ethylideneamino]-2-(4-methoxyphenoxy)acetamide
CID 914091
[1-(2-hydroxy-5-methylphenyl)ethylideneamino]urea
CID 4521675
N-[(E)-1-(2,4-dimethyl-1H-pyrrol-3-yl)ethylideneamino]-2-(4-ethylphenoxy)acetamide
CID 135722958
N-[(Z)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]-2-(4-methoxyphenoxy)acetamide
CID 136690202
5-[(Z)-N-[[2-(4-ethylphenoxy)acetyl]amino]-C-methylcarbonimidoyl]thiophene-2-carboxylate
CID 8826467

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenoxy)-N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]acetamide?
The IUPAC name of 2-(4-ethylphenoxy)-N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]acetamide (CID 135575983) is 2-(4-ethylphenoxy)-N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]acetamide.
What is the SMILES notation for 2-(4-ethylphenoxy)-N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]acetamide?
The canonical SMILES for 2-(4-ethylphenoxy)-N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]acetamide is CCc1ccc(OCC(=O)N/N=C(\C)c2cc(C)ccc2O)cc1.
What is the InChIKey of 2-(4-ethylphenoxy)-N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]acetamide?
The InChIKey is RNSDCFBRZFFAKF-XSFVSMFZSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-4-15-6-8-16(9-7-15)24-12-19(23)21-20-14(3)17-11-13(2)5-10-18(17)22/h5-11,22H,4,12H2,1-3H3,(H,21,23)/b20-14+.
What are the key properties of 2-(4-ethylphenoxy)-N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]acetamide?
2-(4-ethylphenoxy)-N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]acetamide has a molecular weight of 326.40 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-(4-ethylphenoxy)-N-[(E)-1-(2-hydroxy-5-methylphenyl)ethylideneamino]acetamide is sourced from PubChem (CID 135575983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).