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

C12H17NO — CID 17327567

IUPACN-[1-(2,4-dimethylphenyl)ethyl]acetamide
SMILESCC(=O)NC(C)c1ccc(C)cc1C
InChIInChI=1S/C12H17NO/c1-8-5-6-12(9(2)7-8)10(3)13-11(4)14/h5-7,10H,1-4H3,(H,13,14)
InChIKeyULOZUEHHVXHHTA-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.50
Rot. Bonds2

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

N-[1-(2,4-dimethylphenyl)ethyl]acetamide (PubChem CID 17327567) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is N-[1-(2,4-dimethylphenyl)ethyl]acetamide.

Molecular Properties

Compound NameN-[1-(2,4-dimethylphenyl)ethyl]acetamide
PubChem CID17327567
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC NameN-[1-(2,4-dimethylphenyl)ethyl]acetamide
SMILESCC(=O)NC(C)c1ccc(C)cc1C
InChIInChI=1S/C12H17NO/c1-8-5-6-12(9(2)7-8)10(3)13-11(4)14/h5-7,10H,1-4H3,(H,13,14)
InChIKeyULOZUEHHVXHHTA-UHFFFAOYSA-N
XLogP2.50
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-2-amino-N-[1-(2,4-dimethylphenyl)ethyl]propanamide
CID 61146836
N-[(1S)-1-(2,4-dimethylphenyl)ethyl]hydroxylamine
CID 130067534
2-(2,4-dimethylphenyl)-N-[(1S)-1-(2,4-dimethylphenyl)ethyl]acetamide
CID 100749058
N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-2-methylbenzamide
CID 28633869
(2S)-N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-2-(4-methylphenoxy)propanamide
CID 30398925
(2S)-2-amino-N-[1-(2,4-dimethylphenyl)ethyl]-3,3-dimethylbutanamide;hydrochloride
CID 119716665
N-[1-(2,4-dimethylphenyl)ethyl]-2-(prop-2-ynylamino)acetamide
CID 79287564
5-[1-(2,4-dimethylphenyl)ethylamino]-3-methyl-5-oxopentanoic acid
CID 62964709
cis-(1R,2S)-N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-2-methylcyclopropane-1-carboxamide
CID 11922138
(2R)-N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-2-phenoxypropanamide
CID 94843687
1-[(1S)-1-(2,4-dimethylphenyl)ethyl]-3-(3-methylphenyl)urea
CID 27474756
N-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide
CID 43193742

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,4-dimethylphenyl)ethyl]acetamide?
The IUPAC name of N-[1-(2,4-dimethylphenyl)ethyl]acetamide (CID 17327567) is N-[1-(2,4-dimethylphenyl)ethyl]acetamide.
What is the SMILES notation for N-[1-(2,4-dimethylphenyl)ethyl]acetamide?
The canonical SMILES for N-[1-(2,4-dimethylphenyl)ethyl]acetamide is CC(=O)NC(C)c1ccc(C)cc1C.
What is the InChIKey of N-[1-(2,4-dimethylphenyl)ethyl]acetamide?
The InChIKey is ULOZUEHHVXHHTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-8-5-6-12(9(2)7-8)10(3)13-11(4)14/h5-7,10H,1-4H3,(H,13,14).
What are the key properties of N-[1-(2,4-dimethylphenyl)ethyl]acetamide?
N-[1-(2,4-dimethylphenyl)ethyl]acetamide has a molecular weight of 191.27 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,4-dimethylphenyl)ethyl]acetamide is sourced from PubChem (CID 17327567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).