N-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide

C19H23NO2 — CID 108795911

IUPACN-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide
SMILESCCc1ccc(OCCC(=O)Nc2c(C)cccc2C)cc1
InChIInChI=1S/C19H23NO2/c1-4-16-8-10-17(11-9-16)22-13-12-18(21)20-19-14(2)6-5-7-15(19)3/h5-11H,4,12-13H2,1-3H3,(H,20,21)
InChIKeyPDDPIZOICLXHHE-UHFFFAOYSA-N
MW297.40 g/mol
LogP4.27
Rot. Bonds6

About N-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide

N-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide (PubChem CID 108795911) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide
PubChem CID108795911
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide
SMILESCCc1ccc(OCCC(=O)Nc2c(C)cccc2C)cc1
InChIInChI=1S/C19H23NO2/c1-4-16-8-10-17(11-9-16)22-13-12-18(21)20-19-14(2)6-5-7-15(19)3/h5-11H,4,12-13H2,1-3H3,(H,20,21)
InChIKeyPDDPIZOICLXHHE-UHFFFAOYSA-N
XLogP4.27
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-diethylphenyl)-4-(4-ethylphenoxy)butanamide
CID 19174107
4-(4-chlorophenoxy)-N-(2,6-dimethylphenyl)butanamide
CID 7790413
3-(3,5-dimethylphenoxy)-N-(2-ethyl-6-methylphenyl)propanamide
CID 17034730
N-(2-ethyl-6-methylphenyl)-4-(4-methoxyphenoxy)butanamide
CID 7783546
N-(4-butylphenyl)-3-(4-ethylphenoxy)propanamide
CID 108795729
N-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide
CID 1226229
1-(2-ethyl-6-methylphenyl)-3-[2-(4-ethylphenoxy)ethyl]urea
CID 112972102
methyl 2-[3-(4-ethylphenoxy)propanoylamino]benzoate
CID 108795775
N-(2,6-dimethylphenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide
CID 8799242
4-(4-ethylphenoxy)-N-(4-ethylphenyl)butanamide
CID 19173503
[2-(2,6-dimethylanilino)-2-oxoethyl] 3-phenoxypropanoate
CID 7841558
3-(4-ethylphenoxy)-N-(2-phenoxyphenyl)propanamide
CID 108795900

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide?
The IUPAC name of N-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide (CID 108795911) is N-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide is CCc1ccc(OCCC(=O)Nc2c(C)cccc2C)cc1.
What is the InChIKey of N-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide?
The InChIKey is PDDPIZOICLXHHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-4-16-8-10-17(11-9-16)22-13-12-18(21)20-19-14(2)6-5-7-15(19)3/h5-11H,4,12-13H2,1-3H3,(H,20,21).
What are the key properties of N-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide?
N-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide has a molecular weight of 297.40 g/mol, XLogP of 4.27, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide is sourced from PubChem (CID 108795911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).