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

C18H21NO2 — CID 53266277

IUPAC2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide
SMILESCc1ccc(NC(=O)C(C)Oc2ccc(C)c(C)c2)cc1
InChIInChI=1S/C18H21NO2/c1-12-5-8-16(9-6-12)19-18(20)15(4)21-17-10-7-13(2)14(3)11-17/h5-11,15H,1-4H3,(H,19,20)
InChIKeyUXIIBBMOZMMDNU-UHFFFAOYSA-N
MW283.37 g/mol
LogP4.02
Rot. Bonds4

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

2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide (PubChem CID 53266277) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide.

Molecular Properties

Compound Name2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide
PubChem CID53266277
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Name2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide
SMILESCc1ccc(NC(=O)C(C)Oc2ccc(C)c(C)c2)cc1
InChIInChI=1S/C18H21NO2/c1-12-5-8-16(9-6-12)19-18(20)15(4)21-17-10-7-13(2)14(3)11-17/h5-11,15H,1-4H3,(H,19,20)
InChIKeyUXIIBBMOZMMDNU-UHFFFAOYSA-N
XLogP4.02
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-acetylphenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 53266489
N-(4-tert-butylphenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 53266599
methyl 4-[2-(3,4-dimethylphenoxy)propanoylamino]benzoate
CID 53266248
2-(3,4-dimethylphenoxy)-N-[4-(trifluoromethoxy)phenyl]propanamide
CID 133166592
(2S)-2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)propanamide
CID 7610576
2-(3,4-dimethylphenoxy)-N-(4-sulfamoylphenyl)propanamide
CID 2937968
(2S)-N-(3,4-dichlorophenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 95077681
(2S)-N-(4-bromo-3-methylphenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 9173242
ethyl 4-[[(2S)-2-(3,4-dimethylphenoxy)propanoyl]amino]benzoate
CID 889850
N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 53266186
2-(4-chlorophenoxy)-N-(4-methylphenyl)propanamide
CID 4943921
N-(4-methylphenyl)-2-phenoxypropanamide
CID 4639701

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide?
The IUPAC name of 2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide (CID 53266277) is 2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide.
What is the SMILES notation for 2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide?
The canonical SMILES for 2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide is Cc1ccc(NC(=O)C(C)Oc2ccc(C)c(C)c2)cc1.
What is the InChIKey of 2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide?
The InChIKey is UXIIBBMOZMMDNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-12-5-8-16(9-6-12)19-18(20)15(4)21-17-10-7-13(2)14(3)11-17/h5-11,15H,1-4H3,(H,19,20).
What are the key properties of 2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide?
2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide has a molecular weight of 283.37 g/mol, XLogP of 4.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide is sourced from PubChem (CID 53266277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).