2-(4-ethylphenyl)-N-methylacetamide

C11H15NO — CID 56921087

IUPAC2-(4-ethylphenyl)-N-methylacetamide
SMILESCCc1ccc(CC(=O)NC)cc1
InChIInChI=1S/C11H15NO/c1-3-9-4-6-10(7-5-9)8-11(13)12-2/h4-7H,3,8H2,1-2H3,(H,12,13)
InChIKeyDNQKRBFXWKUFLX-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.54
Rot. Bonds3

About 2-(4-ethylphenyl)-N-methylacetamide

2-(4-ethylphenyl)-N-methylacetamide (PubChem CID 56921087) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 2-(4-ethylphenyl)-N-methylacetamide.

Molecular Properties

Compound Name2-(4-ethylphenyl)-N-methylacetamide
PubChem CID56921087
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name2-(4-ethylphenyl)-N-methylacetamide
SMILESCCc1ccc(CC(=O)NC)cc1
InChIInChI=1S/C11H15NO/c1-3-9-4-6-10(7-5-9)8-11(13)12-2/h4-7H,3,8H2,1-2H3,(H,12,13)
InChIKeyDNQKRBFXWKUFLX-UHFFFAOYSA-N
XLogP1.54
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[4-(aminomethyl)phenyl]-N-methylacetamide
CID 23301882
4-[2-(methylamino)-2-oxoethyl]benzoic acid
CID 139022603
2-[4-[[2-(4-ethylphenoxy)acetyl]amino]phenyl]-N-methylacetamide
CID 35364935
2-(4-tert-butylphenyl)-N-methylacetamide;molecular hydrogen
CID 176700295
2-(4-ethylphenyl)-N-[3-(methylamino)propyl]acetamide
CID 119432439
2-[4-(butylamino)phenyl]-N-methylacetamide
CID 43714159
2-(4-ethylphenyl)-N-[2-(methylamino)propyl]acetamide
CID 120832655
N-methyl-2-(4-pyridin-4-ylphenyl)acetamide
CID 39801868
2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 99626723
N-methyl-2-(4-nitrophenyl)acetamide
CID 3389164
N-methyl-2-(4-sulfamoylphenyl)acetamide
CID 43363710
2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide
CID 43214669

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenyl)-N-methylacetamide?
The IUPAC name of 2-(4-ethylphenyl)-N-methylacetamide (CID 56921087) is 2-(4-ethylphenyl)-N-methylacetamide.
What is the SMILES notation for 2-(4-ethylphenyl)-N-methylacetamide?
The canonical SMILES for 2-(4-ethylphenyl)-N-methylacetamide is CCc1ccc(CC(=O)NC)cc1.
What is the InChIKey of 2-(4-ethylphenyl)-N-methylacetamide?
The InChIKey is DNQKRBFXWKUFLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-3-9-4-6-10(7-5-9)8-11(13)12-2/h4-7H,3,8H2,1-2H3,(H,12,13).
What are the key properties of 2-(4-ethylphenyl)-N-methylacetamide?
2-(4-ethylphenyl)-N-methylacetamide has a molecular weight of 177.25 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenyl)-N-methylacetamide is sourced from PubChem (CID 56921087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).