2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide

C20H23ClN2O2 — CID 113170186

IUPAC2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide
SMILESCCc1cccc(CC)c1N(CC(=O)Nc1ccc(Cl)cc1)C(C)=O
InChIInChI=1S/C20H23ClN2O2/c1-4-15-7-6-8-16(5-2)20(15)23(14(3)24)13-19(25)22-18-11-9-17(21)10-12-18/h6-12H,4-5,13H2,1-3H3,(H,22,25)
InChIKeyCCATYXWUBVIDFC-UHFFFAOYSA-N
MW358.87 g/mol
LogP4.46
Rot. Bonds6

About 2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide

2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide (PubChem CID 113170186) has the molecular formula C20H23ClN2O2 and a molecular weight of 358.87 g/mol. Its IUPAC name is 2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide
PubChem CID113170186
Molecular FormulaC20H23ClN2O2
Molecular Weight358.87 g/mol
Exact Mass358.14
IUPAC Name2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide
SMILESCCc1cccc(CC)c1N(CC(=O)Nc1ccc(Cl)cc1)C(C)=O
InChIInChI=1S/C20H23ClN2O2/c1-4-15-7-6-8-16(5-2)20(15)23(14(3)24)13-19(25)22-18-11-9-17(21)10-12-18/h6-12H,4-5,13H2,1-3H3,(H,22,25)
InChIKeyCCATYXWUBVIDFC-UHFFFAOYSA-N
XLogP4.46
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.87
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-2,6-diethylanilino)-N-(3-acetylphenyl)acetamide
CID 113170208
2-(N-acetyl-2,3-dichloroanilino)-N-(4-chlorophenyl)acetamide
CID 113180167
2-(N-acetyl-2-ethyl-6-methylanilino)-N-(4-chloro-2-methylphenyl)acetamide
CID 113169512
2-(N-acetyl-2,6-dichloroanilino)-N-(3-chloro-4-fluorophenyl)acetamide
CID 113180038
2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide
CID 113180044
2-(N-acetyl-2,6-difluoroanilino)-N-(4-fluorophenyl)acetamide
CID 113181479
2-[N-acetyl-4-(dimethylamino)anilino]-N-(4-chlorophenyl)acetamide
CID 113176754
2-(N-acetyl-2,6-diethylanilino)-N-[(2-chlorophenyl)methyl]acetamide
CID 113170122
3-(N-acetyl-2,6-dimethylanilino)-N-(4-chlorophenyl)propanamide
CID 113124917
2-(N-acetyl-2-ethylanilino)-N-phenylacetamide
CID 113169100
2-(N-acetyl-3,5-dimethylanilino)-N-(4-chlorophenyl)acetamide
CID 113168546
2-(N-acetyl-2-ethyl-6-methylanilino)-N-(2,6-dimethylphenyl)acetamide
CID 113169493

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide?
The IUPAC name of 2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide (CID 113170186) is 2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide is CCc1cccc(CC)c1N(CC(=O)Nc1ccc(Cl)cc1)C(C)=O.
What is the InChIKey of 2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide?
The InChIKey is CCATYXWUBVIDFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN2O2/c1-4-15-7-6-8-16(5-2)20(15)23(14(3)24)13-19(25)22-18-11-9-17(21)10-12-18/h6-12H,4-5,13H2,1-3H3,(H,22,25).
What are the key properties of 2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide?
2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide has a molecular weight of 358.87 g/mol, XLogP of 4.46, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide is sourced from PubChem (CID 113170186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).