2-(N-acetyl-2,4-difluoroanilino)-N-(2-propan-2-ylphenyl)acetamide

C19H20F2N2O2 — CID 113179021

IUPAC2-(N-acetyl-2,4-difluoroanilino)-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccccc1C(C)C)c1ccc(F)cc1F
InChIInChI=1S/C19H20F2N2O2/c1-12(2)15-6-4-5-7-17(15)22-19(25)11-23(13(3)24)18-9-8-14(20)10-16(18)21/h4-10,12H,11H2,1-3H3,(H,22,25)
InChIKeyLFJYGOCSEZNVSM-UHFFFAOYSA-N
MW346.38 g/mol
LogP4.08
Rot. Bonds5

About 2-(N-acetyl-2,4-difluoroanilino)-N-(2-propan-2-ylphenyl)acetamide

2-(N-acetyl-2,4-difluoroanilino)-N-(2-propan-2-ylphenyl)acetamide (PubChem CID 113179021) has the molecular formula C19H20F2N2O2 and a molecular weight of 346.38 g/mol. Its IUPAC name is 2-(N-acetyl-2,4-difluoroanilino)-N-(2-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-2,4-difluoroanilino)-N-(2-propan-2-ylphenyl)acetamide
PubChem CID113179021
Molecular FormulaC19H20F2N2O2
Molecular Weight346.38 g/mol
Exact Mass346.15
IUPAC Name2-(N-acetyl-2,4-difluoroanilino)-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccccc1C(C)C)c1ccc(F)cc1F
InChIInChI=1S/C19H20F2N2O2/c1-12(2)15-6-4-5-7-17(15)22-19(25)11-23(13(3)24)18-9-8-14(20)10-16(18)21/h4-10,12H,11H2,1-3H3,(H,22,25)
InChIKeyLFJYGOCSEZNVSM-UHFFFAOYSA-N
XLogP4.08
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.38
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2,4-difluoroanilino)-N-(2-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-2,4-difluoroanilino)-N-(2-propan-2-ylphenyl)acetamide (CID 113179021) is 2-(N-acetyl-2,4-difluoroanilino)-N-(2-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-2,4-difluoroanilino)-N-(2-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-2,4-difluoroanilino)-N-(2-propan-2-ylphenyl)acetamide is CC(=O)N(CC(=O)Nc1ccccc1C(C)C)c1ccc(F)cc1F.
What is the InChIKey of 2-(N-acetyl-2,4-difluoroanilino)-N-(2-propan-2-ylphenyl)acetamide?
The InChIKey is LFJYGOCSEZNVSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F2N2O2/c1-12(2)15-6-4-5-7-17(15)22-19(25)11-23(13(3)24)18-9-8-14(20)10-16(18)21/h4-10,12H,11H2,1-3H3,(H,22,25).
What are the key properties of 2-(N-acetyl-2,4-difluoroanilino)-N-(2-propan-2-ylphenyl)acetamide?
2-(N-acetyl-2,4-difluoroanilino)-N-(2-propan-2-ylphenyl)acetamide has a molecular weight of 346.38 g/mol, XLogP of 4.08, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-2,4-difluoroanilino)-N-(2-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 113179021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).