2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide

C21H27NO — CID 133202118

IUPAC2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide
SMILESCCC(NC(=O)Cc1ccc(C)cc1C)c1ccc(C)c(C)c1
InChIInChI=1S/C21H27NO/c1-6-20(19-10-8-15(3)16(4)12-19)22-21(23)13-18-9-7-14(2)11-17(18)5/h7-12,20H,6,13H2,1-5H3,(H,22,23)
InChIKeyJMDWUFIPXVPTGZ-UHFFFAOYSA-N
MW309.45 g/mol
LogP4.73
Rot. Bonds5

About 2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide

2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide (PubChem CID 133202118) has the molecular formula C21H27NO and a molecular weight of 309.45 g/mol. Its IUPAC name is 2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide
PubChem CID133202118
Molecular FormulaC21H27NO
Molecular Weight309.45 g/mol
Exact Mass309.21
IUPAC Name2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide
SMILESCCC(NC(=O)Cc1ccc(C)cc1C)c1ccc(C)c(C)c1
InChIInChI=1S/C21H27NO/c1-6-20(19-10-8-15(3)16(4)12-19)22-21(23)13-18-9-7-14(2)11-17(18)5/h7-12,20H,6,13H2,1-5H3,(H,22,23)
InChIKeyJMDWUFIPXVPTGZ-UHFFFAOYSA-N
XLogP4.73
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.45
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,4-dimethylphenyl)-N-[1-(4-methylphenyl)propyl]acetamide
CID 133185866
2-(2,5-dimethylphenyl)-N-[1-(4-methylphenyl)propyl]acetamide
CID 43885999
2-(3,4-dimethylphenyl)-N-[1-(4-methylphenyl)propyl]acetamide
CID 132760177
2-(4-chloro-2-fluorophenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide
CID 133161430
2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide
CID 100633604
2-(2,4-dimethylphenyl)-N-[(1S)-1-(2-methylphenyl)propyl]acetamide
CID 100759976
N-[(2S)-butan-2-yl]-2-(2,4-dimethylphenyl)acetamide
CID 95875267
2-(2,5-dimethylphenyl)-N-[(1S)-1-(4-methoxyphenyl)propyl]acetamide
CID 28570284
N-[1-(3,4-dimethylphenyl)propyl]-4-(4-methylphenoxy)butanamide
CID 132652069
2-(2,4-dimethylphenoxy)-N-[(1R)-1-(4-methoxy-3-methylphenyl)propyl]acetamide
CID 100761254
N-[(1S)-1-(3,4-dimethylphenyl)propyl]-2-(4-methoxyphenoxy)acetamide
CID 99993947
3-(3,4-dimethylphenyl)-N-[(1S)-1-(4-methylphenyl)propyl]propanamide
CID 100549740

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide?
The IUPAC name of 2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide (CID 133202118) is 2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide.
What is the SMILES notation for 2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide?
The canonical SMILES for 2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide is CCC(NC(=O)Cc1ccc(C)cc1C)c1ccc(C)c(C)c1.
What is the InChIKey of 2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide?
The InChIKey is JMDWUFIPXVPTGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27NO/c1-6-20(19-10-8-15(3)16(4)12-19)22-21(23)13-18-9-7-14(2)11-17(18)5/h7-12,20H,6,13H2,1-5H3,(H,22,23).
What are the key properties of 2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide?
2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide has a molecular weight of 309.45 g/mol, XLogP of 4.73, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide is sourced from PubChem (CID 133202118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).