2-(2,4-dimethylphenyl)-N-(2-phenylethyl)acetamide

C18H21NO — CID 100770824

IUPAC2-(2,4-dimethylphenyl)-N-(2-phenylethyl)acetamide
SMILESCc1ccc(CC(=O)NCCc2ccccc2)c(C)c1
InChIInChI=1S/C18H21NO/c1-14-8-9-17(15(2)12-14)13-18(20)19-11-10-16-6-4-3-5-7-16/h3-9,12H,10-11,13H2,1-2H3,(H,19,20)
InChIKeyZUOVPGFDOUNRFR-UHFFFAOYSA-N
MW267.37 g/mol
LogP3.20
Rot. Bonds5

About 2-(2,4-dimethylphenyl)-N-(2-phenylethyl)acetamide

2-(2,4-dimethylphenyl)-N-(2-phenylethyl)acetamide (PubChem CID 100770824) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-(2,4-dimethylphenyl)-N-(2-phenylethyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dimethylphenyl)-N-(2-phenylethyl)acetamide
PubChem CID100770824
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name2-(2,4-dimethylphenyl)-N-(2-phenylethyl)acetamide
SMILESCc1ccc(CC(=O)NCCc2ccccc2)c(C)c1
InChIInChI=1S/C18H21NO/c1-14-8-9-17(15(2)12-14)13-18(20)19-11-10-16-6-4-3-5-7-16/h3-9,12H,10-11,13H2,1-2H3,(H,19,20)
InChIKeyZUOVPGFDOUNRFR-UHFFFAOYSA-N
XLogP3.20
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[2-(2,4-dimethylphenyl)ethyl]-3-(2-phenylethyl)urea
CID 3381220
N-(2-aminoethyl)-2-(2,4-dimethylphenyl)acetamide
CID 82283351
N'-(2,4-dimethylphenyl)-N-(2-phenylethyl)butanediamide
CID 4524701
2-(5-methyl-1-benzofuran-3-yl)-N-(2-phenylethyl)acetamide
CID 18872386
2-(7-methyl-2-oxochromen-4-yl)-N-(2-phenylethyl)acetamide
CID 41180238
2-[2-(2,4-dimethylphenyl)ethyl]-1-(2-phenylethyl)guanidine
CID 111075809
2-bromo-N-[2-(2,4-dimethylphenyl)ethyl]acetamide
CID 82109034
N-[2-(2,4-dimethylphenyl)ethyl]-2-sulfanylacetamide
CID 115167356
2-(2,4-dimethylphenyl)sulfonyl-N-(2-phenylethyl)propanamide
CID 86992899
3-(2,4-dimethylphenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 18129621
2-(2,4-dimethylphenyl)-N-[3-(furan-2-yl)propyl]acetamide
CID 100597098
2-iodo-4-methyl-N-(2-phenylethyl)benzamide
CID 100523119

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenyl)-N-(2-phenylethyl)acetamide?
The IUPAC name of 2-(2,4-dimethylphenyl)-N-(2-phenylethyl)acetamide (CID 100770824) is 2-(2,4-dimethylphenyl)-N-(2-phenylethyl)acetamide.
What is the SMILES notation for 2-(2,4-dimethylphenyl)-N-(2-phenylethyl)acetamide?
The canonical SMILES for 2-(2,4-dimethylphenyl)-N-(2-phenylethyl)acetamide is Cc1ccc(CC(=O)NCCc2ccccc2)c(C)c1.
What is the InChIKey of 2-(2,4-dimethylphenyl)-N-(2-phenylethyl)acetamide?
The InChIKey is ZUOVPGFDOUNRFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-14-8-9-17(15(2)12-14)13-18(20)19-11-10-16-6-4-3-5-7-16/h3-9,12H,10-11,13H2,1-2H3,(H,19,20).
What are the key properties of 2-(2,4-dimethylphenyl)-N-(2-phenylethyl)acetamide?
2-(2,4-dimethylphenyl)-N-(2-phenylethyl)acetamide has a molecular weight of 267.37 g/mol, XLogP of 3.20, 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-(2-phenylethyl)acetamide is sourced from PubChem (CID 100770824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).