N-(3,5-dichloro-4-methylphenyl)-2-[ethyl(methyl)amino]acetamide

C12H16Cl2N2O — CID 70810375

IUPACN-(3,5-dichloro-4-methylphenyl)-2-[ethyl(methyl)amino]acetamide
SMILESCCN(C)CC(=O)Nc1cc(Cl)c(C)c(Cl)c1
InChIInChI=1S/C12H16Cl2N2O/c1-4-16(3)7-12(17)15-9-5-10(13)8(2)11(14)6-9/h5-6H,4,7H2,1-3H3,(H,15,17)
InChIKeyYLQDPJXMWMGMNN-UHFFFAOYSA-N
MW275.18 g/mol
LogP3.19
Rot. Bonds4

About N-(3,5-dichloro-4-methylphenyl)-2-[ethyl(methyl)amino]acetamide

N-(3,5-dichloro-4-methylphenyl)-2-[ethyl(methyl)amino]acetamide (PubChem CID 70810375) has the molecular formula C12H16Cl2N2O and a molecular weight of 275.18 g/mol. Its IUPAC name is N-(3,5-dichloro-4-methylphenyl)-2-[ethyl(methyl)amino]acetamide.

Molecular Properties

Compound NameN-(3,5-dichloro-4-methylphenyl)-2-[ethyl(methyl)amino]acetamide
PubChem CID70810375
Molecular FormulaC12H16Cl2N2O
Molecular Weight275.18 g/mol
Exact Mass274.06
IUPAC NameN-(3,5-dichloro-4-methylphenyl)-2-[ethyl(methyl)amino]acetamide
SMILESCCN(C)CC(=O)Nc1cc(Cl)c(C)c(Cl)c1
InChIInChI=1S/C12H16Cl2N2O/c1-4-16(3)7-12(17)15-9-5-10(13)8(2)11(14)6-9/h5-6H,4,7H2,1-3H3,(H,15,17)
InChIKeyYLQDPJXMWMGMNN-UHFFFAOYSA-N
XLogP3.19
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.18
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-amino-4-chlorophenyl)-2-[ethyl(methyl)amino]acetamide
CID 43263033
N-(4-aminophenyl)-2-[ethyl(methyl)amino]acetamide
CID 43263037
3-[[2-(3,4-dichloroanilino)-2-oxoethyl]-methylamino]propanoic acid
CID 60704303
ethyl 3-[[2-(3-chloro-4-methylanilino)-2-oxoethyl]-methylamino]propanoate
CID 62013382
N-(3,5-dichloro-4-methylphenyl)-2-pyrrolidin-1-ylacetamide
CID 23555755
N-(3,4-dichlorophenyl)-2-[methyl-[2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]amino]acetamide
CID 8552057
N-(3-chloro-4-methylphenyl)-2-[ethyl(3-hydroxypropyl)amino]acetamide
CID 115669605
2-[(4-chlorophenyl)methyl-methylamino]-N-(3,5-dimethylphenyl)acetamide
CID 2657408
2-[[2-(3,5-dimethylanilino)-2-oxoethyl]-methylamino]-N-propylacetamide
CID 9302865
2-[butyl(methyl)amino]-N-(3-chloro-4-methoxyphenyl)acetamide
CID 31477725
2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-(3-chloro-4-methylphenyl)acetamide
CID 79652359
N-(3,4-dichlorophenyl)-2-[methyl-[2-[[(2R)-3-methylbutan-2-yl]amino]-2-oxoethyl]amino]acetamide
CID 8709970

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichloro-4-methylphenyl)-2-[ethyl(methyl)amino]acetamide?
The IUPAC name of N-(3,5-dichloro-4-methylphenyl)-2-[ethyl(methyl)amino]acetamide (CID 70810375) is N-(3,5-dichloro-4-methylphenyl)-2-[ethyl(methyl)amino]acetamide.
What is the SMILES notation for N-(3,5-dichloro-4-methylphenyl)-2-[ethyl(methyl)amino]acetamide?
The canonical SMILES for N-(3,5-dichloro-4-methylphenyl)-2-[ethyl(methyl)amino]acetamide is CCN(C)CC(=O)Nc1cc(Cl)c(C)c(Cl)c1.
What is the InChIKey of N-(3,5-dichloro-4-methylphenyl)-2-[ethyl(methyl)amino]acetamide?
The InChIKey is YLQDPJXMWMGMNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16Cl2N2O/c1-4-16(3)7-12(17)15-9-5-10(13)8(2)11(14)6-9/h5-6H,4,7H2,1-3H3,(H,15,17).
What are the key properties of N-(3,5-dichloro-4-methylphenyl)-2-[ethyl(methyl)amino]acetamide?
N-(3,5-dichloro-4-methylphenyl)-2-[ethyl(methyl)amino]acetamide has a molecular weight of 275.18 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichloro-4-methylphenyl)-2-[ethyl(methyl)amino]acetamide is sourced from PubChem (CID 70810375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).