2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide

C19H20Cl2N2O2 — CID 113167737

IUPAC2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide
SMILESCC(=O)N(CC(=O)NCCc1ccc(Cl)cc1Cl)c1ccc(C)cc1
InChIInChI=1S/C19H20Cl2N2O2/c1-13-3-7-17(8-4-13)23(14(2)24)12-19(25)22-10-9-15-5-6-16(20)11-18(15)21/h3-8,11H,9-10,12H2,1-2H3,(H,22,25)
InChIKeyNCOFJWBQHSPALZ-UHFFFAOYSA-N
MW379.29 g/mol
LogP4.01
Rot. Bonds6

About 2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide

2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide (PubChem CID 113167737) has the molecular formula C19H20Cl2N2O2 and a molecular weight of 379.29 g/mol. Its IUPAC name is 2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide
PubChem CID113167737
Molecular FormulaC19H20Cl2N2O2
Molecular Weight379.29 g/mol
Exact Mass378.09
IUPAC Name2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide
SMILESCC(=O)N(CC(=O)NCCc1ccc(Cl)cc1Cl)c1ccc(C)cc1
InChIInChI=1S/C19H20Cl2N2O2/c1-13-3-7-17(8-4-13)23(14(2)24)12-19(25)22-10-9-15-5-6-16(20)11-18(15)21/h3-8,11H,9-10,12H2,1-2H3,(H,22,25)
InChIKeyNCOFJWBQHSPALZ-UHFFFAOYSA-N
XLogP4.01
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.29
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-3-chloro-4-fluoroanilino)-N-[2-(2-fluorophenyl)ethyl]acetamide
CID 113172371
2-(N-acetyl-4-chloroanilino)-N-propylacetamide
CID 113171472
N-[2-(2,4-dichlorophenyl)ethyl]-2-(dipropylamino)acetamide
CID 109006595
2-(N-acetyl-4-methylanilino)-N-[2-(dimethylamino)ethyl]acetamide
CID 113167666
2-[acetyl(3-methoxypropyl)amino]-N-[2-(2,4-dichlorophenyl)ethyl]acetamide
CID 113160075
2-(N-acetyl-3-chloro-4-methylanilino)-N-[(4-methylphenyl)methyl]acetamide
CID 113172188
2-(N-acetyl-4-methylanilino)-N-[3-(dimethylamino)propyl]acetamide
CID 113167668
2-(N-acetyl-3-chloro-4-methylanilino)-N-(2-phenylethyl)acetamide
CID 113172202
N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide
CID 109006978
2-(N-acetyl-4-chloroanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 113171587
methyl 4-[acetyl-[2-[2-(4-chlorophenyl)ethylamino]-2-oxoethyl]amino]benzoate
CID 113176399
4-[2-(2,4-dichlorophenyl)ethylamino]-4-oxobutanoic acid
CID 9151806

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide?
The IUPAC name of 2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide (CID 113167737) is 2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide.
What is the SMILES notation for 2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide?
The canonical SMILES for 2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide is CC(=O)N(CC(=O)NCCc1ccc(Cl)cc1Cl)c1ccc(C)cc1.
What is the InChIKey of 2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide?
The InChIKey is NCOFJWBQHSPALZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl2N2O2/c1-13-3-7-17(8-4-13)23(14(2)24)12-19(25)22-10-9-15-5-6-16(20)11-18(15)21/h3-8,11H,9-10,12H2,1-2H3,(H,22,25).
What are the key properties of 2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide?
2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide has a molecular weight of 379.29 g/mol, XLogP of 4.01, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-4-methylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide is sourced from PubChem (CID 113167737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).