N-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide

C15H13BrFNO2 — CID 2956612

IUPACN-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide
SMILESCOC(C(=O)Nc1ccc(Br)cc1F)c1ccccc1
InChIInChI=1S/C15H13BrFNO2/c1-20-14(10-5-3-2-4-6-10)15(19)18-13-8-7-11(16)9-12(13)17/h2-9,14H,1H3,(H,18,19)
InChIKeyAUURCCLXZDDVML-UHFFFAOYSA-N
MW338.18 g/mol
LogP3.91
Rot. Bonds4

About N-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide

N-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide (PubChem CID 2956612) has the molecular formula C15H13BrFNO2 and a molecular weight of 338.18 g/mol. Its IUPAC name is N-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide.

Molecular Properties

Compound NameN-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide
PubChem CID2956612
Molecular FormulaC15H13BrFNO2
Molecular Weight338.18 g/mol
Exact Mass337.01
IUPAC NameN-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide
SMILESCOC(C(=O)Nc1ccc(Br)cc1F)c1ccccc1
InChIInChI=1S/C15H13BrFNO2/c1-20-14(10-5-3-2-4-6-10)15(19)18-13-8-7-11(16)9-12(13)17/h2-9,14H,1H3,(H,18,19)
InChIKeyAUURCCLXZDDVML-UHFFFAOYSA-N
XLogP3.91
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.18
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide 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

N-(2-fluoro-4,5-dimethoxyphenyl)-2-methoxy-2-phenylacetamide
CID 56782949
(2R)-N-[2-(5-bromo-2-fluorophenyl)ethyl]-2-methoxy-2-phenylacetamide
CID 95153820
(2S)-N-(3-fluoro-4-pyridinyl)-2-methoxy-2-phenylacetamide
CID 124574279
3-(4-bromo-2-fluoroanilino)-2-methyl-3-oxopropanoic acid
CID 114897183
2-bromo-N-(4-bromo-2-fluorophenyl)butanamide
CID 62856454
N-(2-amino-4-methylphenyl)-2-methoxy-2-phenylacetamide
CID 62099409
N-(2,6-difluorophenyl)-2-methoxy-2-phenylacetamide
CID 2955946
2-amino-N-(4-bromo-2-fluorophenyl)propanamide
CID 24708230
1-(4-bromo-2-fluorophenyl)-3-phenylurea
CID 897521
N-(3,4-difluorophenyl)-2-methoxy-2-phenylacetamide
CID 2956436
N-(4-bromo-2-fluorophenyl)-2-methylbutanamide
CID 4635921
N-hydroxy-2-methoxy-2-phenylacetamide
CID 14200442

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide?
The IUPAC name of N-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide (CID 2956612) is N-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide.
What is the SMILES notation for N-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide?
The canonical SMILES for N-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide is COC(C(=O)Nc1ccc(Br)cc1F)c1ccccc1.
What is the InChIKey of N-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide?
The InChIKey is AUURCCLXZDDVML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrFNO2/c1-20-14(10-5-3-2-4-6-10)15(19)18-13-8-7-11(16)9-12(13)17/h2-9,14H,1H3,(H,18,19).
What are the key properties of N-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide?
N-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide has a molecular weight of 338.18 g/mol, XLogP of 3.91, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2-fluorophenyl)-2-methoxy-2-phenylacetamide is sourced from PubChem (CID 2956612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).