2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide

C14H11Br2FN2O — CID 61005304

IUPAC2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide
SMILESNC(=O)C(Nc1cccc(Br)c1)c1ccc(Br)cc1F
InChIInChI=1S/C14H11Br2FN2O/c15-8-2-1-3-10(6-8)19-13(14(18)20)11-5-4-9(16)7-12(11)17/h1-7,13,19H,(H2,18,20)
InChIKeyYDMWEQYMAZVBKJ-UHFFFAOYSA-N
MW402.06 g/mol
LogP3.99
Rot. Bonds4

About 2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide

2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide (PubChem CID 61005304) has the molecular formula C14H11Br2FN2O and a molecular weight of 402.06 g/mol. Its IUPAC name is 2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide
PubChem CID61005304
Molecular FormulaC14H11Br2FN2O
Molecular Weight402.06 g/mol
Exact Mass399.92
IUPAC Name2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide
SMILESNC(=O)C(Nc1cccc(Br)c1)c1ccc(Br)cc1F
InChIInChI=1S/C14H11Br2FN2O/c15-8-2-1-3-10(6-8)19-13(14(18)20)11-5-4-9(16)7-12(11)17/h1-7,13,19H,(H2,18,20)
InChIKeyYDMWEQYMAZVBKJ-UHFFFAOYSA-N
XLogP3.99
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.06
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-bromoanilino)-2-(2,4-dichlorophenyl)acetamide
CID 61005205
2-(5-bromo-2-fluorophenyl)-2-(3-methylanilino)acetamide
CID 61005182
2-anilino-2-(4-bromo-2-fluorophenyl)acetic acid
CID 54890074
2-(3-bromoanilino)-2-(4-chlorophenyl)acetamide
CID 54891742
methyl 2-(3-bromoanilino)-2-(2-fluorophenyl)acetate
CID 60992716
2-anilino-2-(2,4-difluorophenyl)acetamide
CID 54889357
2-(3-bromoanilino)-2-(4-propan-2-ylphenyl)acetamide
CID 61006544
2-(5-bromo-2-fluorophenyl)-2-(4-fluoroanilino)acetamide
CID 61004958
2-(3-bromo-4-chloroanilino)-2-(4-chloro-2-fluorophenyl)acetamide
CID 114843602
2-(3-bromoanilino)-3-hydroxypropanamide
CID 104711177
2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide
CID 54894373
2-(4-bromo-2-fluorophenyl)-2-hydroxyacetamide
CID 62225649

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide?
The IUPAC name of 2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide (CID 61005304) is 2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide.
What is the SMILES notation for 2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide?
The canonical SMILES for 2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide is NC(=O)C(Nc1cccc(Br)c1)c1ccc(Br)cc1F.
What is the InChIKey of 2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide?
The InChIKey is YDMWEQYMAZVBKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Br2FN2O/c15-8-2-1-3-10(6-8)19-13(14(18)20)11-5-4-9(16)7-12(11)17/h1-7,13,19H,(H2,18,20).
What are the key properties of 2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide?
2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide has a molecular weight of 402.06 g/mol, XLogP of 3.99, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromoanilino)-2-(4-bromo-2-fluorophenyl)acetamide is sourced from PubChem (CID 61005304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).