3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide

C19H23NO2 — CID 39992819

IUPAC3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide
SMILESCCc1ccccc1NC(=O)CCOc1ccc(C)c(C)c1
InChIInChI=1S/C19H23NO2/c1-4-16-7-5-6-8-18(16)20-19(21)11-12-22-17-10-9-14(2)15(3)13-17/h5-10,13H,4,11-12H2,1-3H3,(H,20,21)
InChIKeyXHNSEFYPMDPUQI-UHFFFAOYSA-N
MW297.40 g/mol
LogP4.27
Rot. Bonds6

About 3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide

3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide (PubChem CID 39992819) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide.

Molecular Properties

Compound Name3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide
PubChem CID39992819
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide
SMILESCCc1ccccc1NC(=O)CCOc1ccc(C)c(C)c1
InChIInChI=1S/C19H23NO2/c1-4-16-7-5-6-8-18(16)20-19(21)11-12-22-17-10-9-14(2)15(3)13-17/h5-10,13H,4,11-12H2,1-3H3,(H,20,21)
InChIKeyXHNSEFYPMDPUQI-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

4-(4-chloro-3-methylphenoxy)-N-(2-ethylphenyl)butanamide
CID 4797069
N-(2-aminophenyl)-4-(3,4-dimethylphenoxy)butanamide;hydrochloride
CID 119422856
N-(5-amino-2-methylphenyl)-3-(3,4-dimethylphenoxy)propanamide;hydrochloride
CID 120568118
N-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide
CID 119439844
4-[(3,4-dimethylphenoxy)methyl]-N-(2-ethylphenyl)benzamide
CID 1303331
2-[2-[3-(3,5-dimethylphenoxy)propanoylamino]phenyl]acetic acid
CID 119218262
N-[2-(bromomethyl)phenyl]-3-(3-methylphenoxy)propanamide
CID 114309727
4-(4-tert-butylphenoxy)-N-(2-ethylphenyl)butanamide
CID 19173562
N-(4-chloro-2,5-dimethoxyphenyl)-3-(3,4-dimethylphenoxy)propanamide
CID 55572968
N-(2-methylphenyl)-3-phenoxypropanamide
CID 725619
2-[4-[2-(3,4-dimethylphenoxy)acetyl]piperazin-1-ium-1-yl]-N-(2-ethylphenyl)acetamide
CID 9022276
3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide
CID 47023614

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide?
The IUPAC name of 3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide (CID 39992819) is 3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide.
What is the SMILES notation for 3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide?
The canonical SMILES for 3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide is CCc1ccccc1NC(=O)CCOc1ccc(C)c(C)c1.
What is the InChIKey of 3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide?
The InChIKey is XHNSEFYPMDPUQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-4-16-7-5-6-8-18(16)20-19(21)11-12-22-17-10-9-14(2)15(3)13-17/h5-10,13H,4,11-12H2,1-3H3,(H,20,21).
What are the key properties of 3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide?
3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)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 3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide is sourced from PubChem (CID 39992819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).