N-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide

C15H13BrFNO — CID 43806426

IUPACN-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide
SMILESCc1ccc(Br)cc1NC(=O)Cc1cccc(F)c1
InChIInChI=1S/C15H13BrFNO/c1-10-5-6-12(16)9-14(10)18-15(19)8-11-3-2-4-13(17)7-11/h2-7,9H,8H2,1H3,(H,18,19)
InChIKeyYTPIXGCIWZEIDT-UHFFFAOYSA-N
MW322.18 g/mol
LogP4.08
Rot. Bonds3

About N-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide

N-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide (PubChem CID 43806426) has the molecular formula C15H13BrFNO and a molecular weight of 322.18 g/mol. Its IUPAC name is N-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide
PubChem CID43806426
Molecular FormulaC15H13BrFNO
Molecular Weight322.18 g/mol
Exact Mass321.02
IUPAC NameN-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide
SMILESCc1ccc(Br)cc1NC(=O)Cc1cccc(F)c1
InChIInChI=1S/C15H13BrFNO/c1-10-5-6-12(16)9-14(10)18-15(19)8-11-3-2-4-13(17)7-11/h2-7,9H,8H2,1H3,(H,18,19)
InChIKeyYTPIXGCIWZEIDT-UHFFFAOYSA-N
XLogP4.08
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.18
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(5-bromo-4-fluoro-2-methylphenyl)-2-(3-fluorophenyl)acetamide
CID 103274575
N-(5-amino-2,4-dimethylphenyl)-2-(3-fluorophenyl)acetamide
CID 104757005
N-[3-[[2-(3-fluorophenyl)acetyl]amino]-4-methylphenyl]propanamide
CID 46467166
2-(3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide
CID 154859403
2-(3-fluorophenyl)-N-(3-hydroxy-2-methylphenyl)acetamide
CID 64793447
N-(3,4-dimethylphenyl)-2-(3-fluorophenyl)acetamide
CID 8743428
N-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide
CID 103842716
N-(2-acetamido-5-bromophenyl)-3-(3-fluorophenyl)propanamide
CID 60621107
2-(3-bromophenyl)-N-[2-(2,5-dimethylanilino)-2-oxoethyl]acetamide
CID 112996471
N-(2-amino-4-methylphenyl)-2-(3-fluorophenyl)acetamide
CID 43259058
N-(5-bromo-2-methylphenyl)butanamide
CID 43806329
N-(5-fluoro-2-methoxyphenyl)-2-(3-fluorophenyl)acetamide
CID 110776591

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide?
The IUPAC name of N-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide (CID 43806426) is N-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide.
What is the SMILES notation for N-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide?
The canonical SMILES for N-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide is Cc1ccc(Br)cc1NC(=O)Cc1cccc(F)c1.
What is the InChIKey of N-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide?
The InChIKey is YTPIXGCIWZEIDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrFNO/c1-10-5-6-12(16)9-14(10)18-15(19)8-11-3-2-4-13(17)7-11/h2-7,9H,8H2,1H3,(H,18,19).
What are the key properties of N-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide?
N-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide has a molecular weight of 322.18 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide is sourced from PubChem (CID 43806426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).