2-amino-N-(4-bromo-2,6-difluorophenyl)-2-(4-methylphenyl)acetamide

C15H13BrF2N2O — CID 106312451

IUPAC2-amino-N-(4-bromo-2,6-difluorophenyl)-2-(4-methylphenyl)acetamide
SMILESCc1ccc(C(N)C(=O)Nc2c(F)cc(Br)cc2F)cc1
InChIInChI=1S/C15H13BrF2N2O/c1-8-2-4-9(5-3-8)13(19)15(21)20-14-11(17)6-10(16)7-12(14)18/h2-7,13H,19H2,1H3,(H,20,21)
InChIKeyPTMBSFAKNSDUEU-UHFFFAOYSA-N
MW355.18 g/mol
LogP3.67
Rot. Bonds3

About 2-amino-N-(4-bromo-2,6-difluorophenyl)-2-(4-methylphenyl)acetamide

2-amino-N-(4-bromo-2,6-difluorophenyl)-2-(4-methylphenyl)acetamide (PubChem CID 106312451) has the molecular formula C15H13BrF2N2O and a molecular weight of 355.18 g/mol. Its IUPAC name is 2-amino-N-(4-bromo-2,6-difluorophenyl)-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-amino-N-(4-bromo-2,6-difluorophenyl)-2-(4-methylphenyl)acetamide
PubChem CID106312451
Molecular FormulaC15H13BrF2N2O
Molecular Weight355.18 g/mol
Exact Mass354.02
IUPAC Name2-amino-N-(4-bromo-2,6-difluorophenyl)-2-(4-methylphenyl)acetamide
SMILESCc1ccc(C(N)C(=O)Nc2c(F)cc(Br)cc2F)cc1
InChIInChI=1S/C15H13BrF2N2O/c1-8-2-4-9(5-3-8)13(19)15(21)20-14-11(17)6-10(16)7-12(14)18/h2-7,13H,19H2,1H3,(H,20,21)
InChIKeyPTMBSFAKNSDUEU-UHFFFAOYSA-N
XLogP3.67
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.18
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-(4-bromo-2,6-difluorophenyl)propanamide
CID 79009037
2-amino-N-(5-bromo-4-fluoro-2-methylphenyl)-2-(4-methylphenyl)acetamide
CID 106312877
2-amino-N-(2-bromo-4-methylphenyl)-2-(4-methylphenyl)acetamide
CID 106312006
2-amino-N-(4-bromo-2,6-difluorophenyl)-3-methoxypropanamide
CID 81101709
2-amino-N-(2-chloro-5-fluorophenyl)-2-(4-methylphenyl)acetamide
CID 106312872
2-amino-N-(3-chloro-5-fluorophenyl)-2-(4-methylphenyl)acetamide
CID 106312862
2-amino-N-(4-fluoro-2-iodophenyl)-2-(4-methylphenyl)acetamide
CID 106312524
N-[4-[[2-amino-2-(4-methylphenyl)acetyl]amino]phenyl]-2-methylpropanamide
CID 120666693
2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide
CID 106312111
3-amino-N-(4-bromo-2,6-difluorophenyl)-2-methoxypropanamide
CID 114145118
2-amino-N-(4-bromo-2,6-difluorophenyl)-4-methylsulfonylbutanamide
CID 65469928
2-amino-N-(2-aminoethyl)-2-(4-methylphenyl)acetamide
CID 106151018

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-bromo-2,6-difluorophenyl)-2-(4-methylphenyl)acetamide?
The IUPAC name of 2-amino-N-(4-bromo-2,6-difluorophenyl)-2-(4-methylphenyl)acetamide (CID 106312451) is 2-amino-N-(4-bromo-2,6-difluorophenyl)-2-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-amino-N-(4-bromo-2,6-difluorophenyl)-2-(4-methylphenyl)acetamide?
The canonical SMILES for 2-amino-N-(4-bromo-2,6-difluorophenyl)-2-(4-methylphenyl)acetamide is Cc1ccc(C(N)C(=O)Nc2c(F)cc(Br)cc2F)cc1.
What is the InChIKey of 2-amino-N-(4-bromo-2,6-difluorophenyl)-2-(4-methylphenyl)acetamide?
The InChIKey is PTMBSFAKNSDUEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrF2N2O/c1-8-2-4-9(5-3-8)13(19)15(21)20-14-11(17)6-10(16)7-12(14)18/h2-7,13H,19H2,1H3,(H,20,21).
What are the key properties of 2-amino-N-(4-bromo-2,6-difluorophenyl)-2-(4-methylphenyl)acetamide?
2-amino-N-(4-bromo-2,6-difluorophenyl)-2-(4-methylphenyl)acetamide has a molecular weight of 355.18 g/mol, XLogP of 3.67, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-bromo-2,6-difluorophenyl)-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 106312451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).