2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide

C15H14F2N2O — CID 28879023

IUPAC2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CNc1c(F)cccc1F
InChIInChI=1S/C15H14F2N2O/c1-10-5-2-3-8-13(10)19-14(20)9-18-15-11(16)6-4-7-12(15)17/h2-8,18H,9H2,1H3,(H,19,20)
InChIKeyMLNCXRDCADFUNV-UHFFFAOYSA-N
MW276.29 g/mol
LogP3.32
Rot. Bonds4

About 2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide

2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide (PubChem CID 28879023) has the molecular formula C15H14F2N2O and a molecular weight of 276.29 g/mol. Its IUPAC name is 2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide
PubChem CID28879023
Molecular FormulaC15H14F2N2O
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC Name2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CNc1c(F)cccc1F
InChIInChI=1S/C15H14F2N2O/c1-10-5-2-3-8-13(10)19-14(20)9-18-15-11(16)6-4-7-12(15)17/h2-8,18H,9H2,1H3,(H,19,20)
InChIKeyMLNCXRDCADFUNV-UHFFFAOYSA-N
XLogP3.32
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide (CID 28879023) is 2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide is Cc1ccccc1NC(=O)CNc1c(F)cccc1F.
What is the InChIKey of 2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide?
The InChIKey is MLNCXRDCADFUNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O/c1-10-5-2-3-8-13(10)19-14(20)9-18-15-11(16)6-4-7-12(15)17/h2-8,18H,9H2,1H3,(H,19,20).
What are the key properties of 2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide?
2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide has a molecular weight of 276.29 g/mol, XLogP of 3.32, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 28879023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).