N-(4-amino-2-ethyl-6-methylphenyl)-2-(4-methoxyphenoxy)acetamide

C18H22N2O3 — CID 50880901

IUPACN-(4-amino-2-ethyl-6-methylphenyl)-2-(4-methoxyphenoxy)acetamide
SMILESCCc1cc(N)cc(C)c1NC(=O)COc1ccc(OC)cc1
InChIInChI=1S/C18H22N2O3/c1-4-13-10-14(19)9-12(2)18(13)20-17(21)11-23-16-7-5-15(22-3)6-8-16/h5-10H,4,11,19H2,1-3H3,(H,20,21)
InChIKeyMURQHFQOAUUBBF-UHFFFAOYSA-N
MW314.39 g/mol
LogP3.17
Rot. Bonds6

About N-(4-amino-2-ethyl-6-methylphenyl)-2-(4-methoxyphenoxy)acetamide

N-(4-amino-2-ethyl-6-methylphenyl)-2-(4-methoxyphenoxy)acetamide (PubChem CID 50880901) has the molecular formula C18H22N2O3 and a molecular weight of 314.39 g/mol. Its IUPAC name is N-(4-amino-2-ethyl-6-methylphenyl)-2-(4-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(4-amino-2-ethyl-6-methylphenyl)-2-(4-methoxyphenoxy)acetamide
PubChem CID50880901
Molecular FormulaC18H22N2O3
Molecular Weight314.39 g/mol
Exact Mass314.16
IUPAC NameN-(4-amino-2-ethyl-6-methylphenyl)-2-(4-methoxyphenoxy)acetamide
SMILESCCc1cc(N)cc(C)c1NC(=O)COc1ccc(OC)cc1
InChIInChI=1S/C18H22N2O3/c1-4-13-10-14(19)9-12(2)18(13)20-17(21)11-23-16-7-5-15(22-3)6-8-16/h5-10H,4,11,19H2,1-3H3,(H,20,21)
InChIKeyMURQHFQOAUUBBF-UHFFFAOYSA-N
XLogP3.17
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(4-amino-2,6-dimethylphenyl)-2-(4-chlorophenoxy)acetamide
CID 50881036
N-(4-amino-2,6-dimethylphenyl)-2-(4-methoxyphenyl)acetamide
CID 79993432
N-(4-amino-2-bromo-6-methylphenyl)-2-(4-methylphenoxy)acetamide
CID 100828316
N-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide
CID 100828362
2-(3,5-dimethylphenoxy)-N-(2-ethyl-6-methylphenyl)acetamide
CID 769435
N-(2-ethyl-6-methylphenyl)-4-(4-methoxyphenoxy)butanamide
CID 7783546
N-(2,4-dimethylphenyl)-2-(4-methoxyphenoxy)acetamide
CID 625191
2-(4-methoxyphenoxy)-N-[(2,4,6-trimethylphenyl)carbamothioyl]acetamide
CID 5162446
N-(2-ethyl-6-methylphenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide
CID 19172373
methyl 3-[[2-(4-methoxyphenoxy)acetyl]amino]-4-methylbenzoate
CID 806985
4-[2-oxo-2-(2,4,6-trimethylanilino)ethoxy]benzamide
CID 7931575
N-(2,6-dimethylphenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide
CID 26904107

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2-ethyl-6-methylphenyl)-2-(4-methoxyphenoxy)acetamide?
The IUPAC name of N-(4-amino-2-ethyl-6-methylphenyl)-2-(4-methoxyphenoxy)acetamide (CID 50880901) is N-(4-amino-2-ethyl-6-methylphenyl)-2-(4-methoxyphenoxy)acetamide.
What is the SMILES notation for N-(4-amino-2-ethyl-6-methylphenyl)-2-(4-methoxyphenoxy)acetamide?
The canonical SMILES for N-(4-amino-2-ethyl-6-methylphenyl)-2-(4-methoxyphenoxy)acetamide is CCc1cc(N)cc(C)c1NC(=O)COc1ccc(OC)cc1.
What is the InChIKey of N-(4-amino-2-ethyl-6-methylphenyl)-2-(4-methoxyphenoxy)acetamide?
The InChIKey is MURQHFQOAUUBBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3/c1-4-13-10-14(19)9-12(2)18(13)20-17(21)11-23-16-7-5-15(22-3)6-8-16/h5-10H,4,11,19H2,1-3H3,(H,20,21).
What are the key properties of N-(4-amino-2-ethyl-6-methylphenyl)-2-(4-methoxyphenoxy)acetamide?
N-(4-amino-2-ethyl-6-methylphenyl)-2-(4-methoxyphenoxy)acetamide has a molecular weight of 314.39 g/mol, XLogP of 3.17, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2-ethyl-6-methylphenyl)-2-(4-methoxyphenoxy)acetamide is sourced from PubChem (CID 50880901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).