2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide

C18H18Cl2N2O2 — CID 109007008

IUPAC2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide
SMILESCC(=O)c1cccc(NCC(=O)NCCc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C18H18Cl2N2O2/c1-12(23)14-3-2-4-16(9-14)22-11-18(24)21-8-7-13-5-6-15(19)10-17(13)20/h2-6,9-10,22H,7-8,11H2,1H3,(H,21,24)
InChIKeyOWSURWVZXLECLS-UHFFFAOYSA-N
MW365.26 g/mol
LogP3.97
Rot. Bonds7

About 2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide

2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide (PubChem CID 109007008) has the molecular formula C18H18Cl2N2O2 and a molecular weight of 365.26 g/mol. Its IUPAC name is 2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide
PubChem CID109007008
Molecular FormulaC18H18Cl2N2O2
Molecular Weight365.26 g/mol
Exact Mass364.07
IUPAC Name2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide
SMILESCC(=O)c1cccc(NCC(=O)NCCc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C18H18Cl2N2O2/c1-12(23)14-3-2-4-16(9-14)22-11-18(24)21-8-7-13-5-6-15(19)10-17(13)20/h2-6,9-10,22H,7-8,11H2,1H3,(H,21,24)
InChIKeyOWSURWVZXLECLS-UHFFFAOYSA-N
XLogP3.97
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.26
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(3-acetylphenyl)-N-[2-(2,4-dichlorophenyl)ethyl]oxamide
CID 108986646
N-(3-acetylphenyl)-3-(2,4-dichlorophenyl)propanamide
CID 100606597
N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,6-difluoroanilino)acetamide
CID 109007030
3-(4-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide
CID 109033422
N-[3-[2-(2,4-dichlorophenyl)ethylcarbamoylamino]phenyl]acetamide
CID 108991040
1-[3-[2-(2-chlorophenyl)ethylamino]phenyl]ethanone
CID 75397038
N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide
CID 26506544
2-(3-acetylanilino)-N-(3-chloro-4-fluorophenyl)acetamide
CID 9084520
3-(3-acetylanilino)-N-[2-(3-chlorophenyl)ethyl]propanamide
CID 109033251
2-(3-acetamidoanilino)-N-[2-(3-chlorophenyl)ethyl]acetamide
CID 109006850
N-[2-(2,4-dichlorophenyl)ethyl]-2-(2,4-dimethylanilino)acetamide
CID 109006978
N-[2-(3-chlorophenyl)ethyl]-2-[2-(2,4-dichlorophenyl)ethylamino]acetamide
CID 109006805

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide?
The IUPAC name of 2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide (CID 109007008) is 2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide.
What is the SMILES notation for 2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide?
The canonical SMILES for 2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide is CC(=O)c1cccc(NCC(=O)NCCc2ccc(Cl)cc2Cl)c1.
What is the InChIKey of 2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide?
The InChIKey is OWSURWVZXLECLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Cl2N2O2/c1-12(23)14-3-2-4-16(9-14)22-11-18(24)21-8-7-13-5-6-15(19)10-17(13)20/h2-6,9-10,22H,7-8,11H2,1H3,(H,21,24).
What are the key properties of 2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide?
2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide has a molecular weight of 365.26 g/mol, XLogP of 3.97, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetylanilino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide is sourced from PubChem (CID 109007008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).