2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide

C20H24N2O2 — CID 9103726

IUPAC2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide
SMILESCC(=O)c1ccccc1NCC(=O)Nc1ccc(C(C)(C)C)cc1
InChIInChI=1S/C20H24N2O2/c1-14(23)17-7-5-6-8-18(17)21-13-19(24)22-16-11-9-15(10-12-16)20(2,3)4/h5-12,21H,13H2,1-4H3,(H,22,24)
InChIKeyVFARPBQJUBIIJO-UHFFFAOYSA-N
MW324.42 g/mol
LogP4.24
Rot. Bonds5

About 2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide

2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide (PubChem CID 9103726) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide
PubChem CID9103726
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide
SMILESCC(=O)c1ccccc1NCC(=O)Nc1ccc(C(C)(C)C)cc1
InChIInChI=1S/C20H24N2O2/c1-14(23)17-7-5-6-8-18(17)21-13-19(24)22-16-11-9-15(10-12-16)20(2,3)4/h5-12,21H,13H2,1-4H3,(H,22,24)
InChIKeyVFARPBQJUBIIJO-UHFFFAOYSA-N
XLogP4.24
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-acetylanilino)-N-phenylacetamide
CID 9103782
2-(2-acetylanilino)-N-(4-methylsulfonylphenyl)acetamide
CID 42027103
2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide
CID 9106347
2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide
CID 18078616
ethyl 2-[[2-(4-acetylanilino)-2-oxoethyl]amino]benzoate
CID 109009916
N-(4-tert-butylphenyl)-N'-(2-methylphenyl)propanediamide
CID 108952923
N-(2-acetylphenyl)-2-(4-phenylanilino)acetamide
CID 39912347
N-(4-chlorophenyl)-2-[[2-(4-methylanilino)-2-oxoethyl]amino]benzamide
CID 18205586
2-[(2-anilino-2-oxoethyl)amino]-N-(4-methoxyphenyl)benzamide
CID 9105493
N'-(4-tert-butylphenyl)-N-phenylpropanediamide
CID 108952831
2-[[2-(3-acetylanilino)-2-oxoethyl]amino]-N-(4-chlorophenyl)benzamide
CID 18228642
N-(4-tert-butylphenyl)-2-(methylamino)benzamide
CID 60706403

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide?
The IUPAC name of 2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide (CID 9103726) is 2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide.
What is the SMILES notation for 2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide?
The canonical SMILES for 2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide is CC(=O)c1ccccc1NCC(=O)Nc1ccc(C(C)(C)C)cc1.
What is the InChIKey of 2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide?
The InChIKey is VFARPBQJUBIIJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-14(23)17-7-5-6-8-18(17)21-13-19(24)22-16-11-9-15(10-12-16)20(2,3)4/h5-12,21H,13H2,1-4H3,(H,22,24).
What are the key properties of 2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide?
2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide has a molecular weight of 324.42 g/mol, XLogP of 4.24, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide is sourced from PubChem (CID 9103726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).