2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide

C18H21NO — CID 43905087

IUPAC2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide
SMILESCc1ccc(C)c(CC(=O)NC(C)c2ccccc2)c1
InChIInChI=1S/C18H21NO/c1-13-9-10-14(2)17(11-13)12-18(20)19-15(3)16-7-5-4-6-8-16/h4-11,15H,12H2,1-3H3,(H,19,20)
InChIKeyBIFVWLKPNFONDC-UHFFFAOYSA-N
MW267.37 g/mol
LogP3.72
Rot. Bonds4

About 2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide

2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide (PubChem CID 43905087) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide
PubChem CID43905087
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide
SMILESCc1ccc(C)c(CC(=O)NC(C)c2ccccc2)c1
InChIInChI=1S/C18H21NO/c1-13-9-10-14(2)17(11-13)12-18(20)19-15(3)16-7-5-4-6-8-16/h4-11,15H,12H2,1-3H3,(H,19,20)
InChIKeyBIFVWLKPNFONDC-UHFFFAOYSA-N
XLogP3.72
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-2-[[2-(2,5-dimethylphenyl)acetyl]amino]propanoic acid
CID 62538173
N-[(2,5-dimethylphenyl)methyl]-1-phenylethanamine
CID 60684201
2-(2,4-dimethylphenyl)sulfanyl-N-(1-phenylethyl)acetamide
CID 6915473
2-(2,5-dimethylphenyl)-N-[(1S)-1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]acetamide
CID 95288291
2-[(2,4-dimethylphenyl)methyl-methylamino]-N-(1-phenylethyl)acetamide
CID 18197627
N-[1-(4-bromophenyl)ethyl]-2-(2-methylphenyl)acetamide
CID 47106591
5-[[2-(2,5-dimethylphenyl)acetyl]amino]hexanoic acid
CID 82854155
ethyl 2-[[2-(2,5-dimethylphenyl)acetyl]amino]propanoate
CID 62538862
2-(2-aminophenyl)-N-[1-(4-methylphenyl)ethyl]acetamide
CID 61102579
2-(2,5-dimethylphenyl)-N-[1-(4-methylphenyl)propyl]acetamide
CID 43885999
(2S)-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-3,3-dimethylbutanoic acid
CID 62538832
N-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide
CID 54812168

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide?
The IUPAC name of 2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide (CID 43905087) is 2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide?
The canonical SMILES for 2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide is Cc1ccc(C)c(CC(=O)NC(C)c2ccccc2)c1.
What is the InChIKey of 2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide?
The InChIKey is BIFVWLKPNFONDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-13-9-10-14(2)17(11-13)12-18(20)19-15(3)16-7-5-4-6-8-16/h4-11,15H,12H2,1-3H3,(H,19,20).
What are the key properties of 2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide?
2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide has a molecular weight of 267.37 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide is sourced from PubChem (CID 43905087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).