2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide

C17H17FN2O2 — CID 18096453

IUPAC2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide
SMILESCC(=O)c1ccc(NCC(=O)Nc2cc(F)ccc2C)cc1
InChIInChI=1S/C17H17FN2O2/c1-11-3-6-14(18)9-16(11)20-17(22)10-19-15-7-4-13(5-8-15)12(2)21/h3-9,19H,10H2,1-2H3,(H,20,22)
InChIKeyPSHXLAQWYNTNON-UHFFFAOYSA-N
MW300.33 g/mol
LogP3.39
Rot. Bonds5

About 2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide

2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide (PubChem CID 18096453) has the molecular formula C17H17FN2O2 and a molecular weight of 300.33 g/mol. Its IUPAC name is 2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide
PubChem CID18096453
Molecular FormulaC17H17FN2O2
Molecular Weight300.33 g/mol
Exact Mass300.13
IUPAC Name2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide
SMILESCC(=O)c1ccc(NCC(=O)Nc2cc(F)ccc2C)cc1
InChIInChI=1S/C17H17FN2O2/c1-11-3-6-14(18)9-16(11)20-17(22)10-19-15-7-4-13(5-8-15)12(2)21/h3-9,19H,10H2,1-2H3,(H,20,22)
InChIKeyPSHXLAQWYNTNON-UHFFFAOYSA-N
XLogP3.39
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.33
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-acetylanilino)-N-(2-chloro-4-fluorophenyl)acetamide
CID 26416052
2-(5-fluoro-2-methylanilino)-N-(4-fluorophenyl)acetamide
CID 9099732
N-(5-fluoro-2-methylphenyl)-2-(3-methylsulfonylanilino)acetamide
CID 18125562
2-amino-N-(5-fluoro-2-methylphenyl)acetamide
CID 24700155
N-(5-fluoro-2-methylphenyl)-4-(4-fluorophenyl)-4-oxobutanamide
CID 9211912
4-[[2-(2,5-dimethylanilino)-2-oxoethyl]amino]-N-methylbenzamide
CID 54846091
2-(4-acetylanilino)-N-(3-chloro-4-fluorophenyl)acetamide
CID 9079945
N-(4-acetylphenyl)-2-(4-ethylanilino)acetamide
CID 37465418
3-(4-acetylanilino)-N-(4-fluorophenyl)propanamide
CID 109037659
2-(4-acetylanilino)-N-(4-bromo-3-methylphenyl)acetamide
CID 9079994
2-[(5-fluoro-2-methylphenyl)carbamoylamino]-N-(4-fluorophenyl)acetamide
CID 49277168
2-(3-acetamido-4-methylanilino)-N-(3-acetylphenyl)acetamide
CID 60536243

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide?
The IUPAC name of 2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide (CID 18096453) is 2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide.
What is the SMILES notation for 2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide?
The canonical SMILES for 2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide is CC(=O)c1ccc(NCC(=O)Nc2cc(F)ccc2C)cc1.
What is the InChIKey of 2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide?
The InChIKey is PSHXLAQWYNTNON-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O2/c1-11-3-6-14(18)9-16(11)20-17(22)10-19-15-7-4-13(5-8-15)12(2)21/h3-9,19H,10H2,1-2H3,(H,20,22).
What are the key properties of 2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide?
2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide has a molecular weight of 300.33 g/mol, XLogP of 3.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylanilino)-N-(5-fluoro-2-methylphenyl)acetamide is sourced from PubChem (CID 18096453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).