2-[(4-bromo-2-fluorophenyl)methoxy]benzamide

C14H11BrFNO2 — CID 7640045

IUPAC2-[(4-bromo-2-fluorophenyl)methoxy]benzamide
SMILESNC(=O)c1ccccc1OCc1ccc(Br)cc1F
InChIInChI=1S/C14H11BrFNO2/c15-10-6-5-9(12(16)7-10)8-19-13-4-2-1-3-11(13)14(17)18/h1-7H,8H2,(H2,17,18)
InChIKeyCTXBAPUOMRHLPL-UHFFFAOYSA-N
MW324.15 g/mol
LogP3.27
Rot. Bonds4

About 2-[(4-bromo-2-fluorophenyl)methoxy]benzamide

2-[(4-bromo-2-fluorophenyl)methoxy]benzamide (PubChem CID 7640045) has the molecular formula C14H11BrFNO2 and a molecular weight of 324.15 g/mol. Its IUPAC name is 2-[(4-bromo-2-fluorophenyl)methoxy]benzamide.

Molecular Properties

Compound Name2-[(4-bromo-2-fluorophenyl)methoxy]benzamide
PubChem CID7640045
Molecular FormulaC14H11BrFNO2
Molecular Weight324.15 g/mol
Exact Mass323.00
IUPAC Name2-[(4-bromo-2-fluorophenyl)methoxy]benzamide
SMILESNC(=O)c1ccccc1OCc1ccc(Br)cc1F
InChIInChI=1S/C14H11BrFNO2/c15-10-6-5-9(12(16)7-10)8-19-13-4-2-1-3-11(13)14(17)18/h1-7H,8H2,(H2,17,18)
InChIKeyCTXBAPUOMRHLPL-UHFFFAOYSA-N
XLogP3.27
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.15
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-amino-5-fluorophenyl)methoxy]benzamide
CID 43443894
2-[(2,4-difluorophenyl)methoxy]benzoic acid
CID 62198104
(E)-3-[2-[(4-bromo-2-fluorophenyl)methoxy]phenyl]prop-2-enoic acid
CID 43438791
2-[(4-bromo-2-fluorophenyl)methoxy]-3-methoxybenzoic acid
CID 43471698
2-[(2-bromo-4,5-dimethoxyphenyl)methoxy]benzamide
CID 8939782
2-[(2-bromo-4-fluorophenoxy)methyl]benzamide
CID 24710640
3-[(4-bromo-2-fluorophenyl)methoxy]pyridin-2-amine
CID 43438660
2-[(5-bromo-2-pyridinyl)methoxy]benzamide
CID 104809676
3-fluoro-4-[(2-hydroxyphenoxy)methyl]benzamide
CID 43326327
4-amino-3-[(4-bromo-2-fluorophenyl)methoxy]benzoic acid
CID 43438829
2-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]benzamide
CID 7500273
3-[(4-bromo-2-fluorophenoxy)methyl]-2-fluorobenzenecarbothioamide
CID 107116051

Frequently Asked Questions

What is the IUPAC name of 2-[(4-bromo-2-fluorophenyl)methoxy]benzamide?
The IUPAC name of 2-[(4-bromo-2-fluorophenyl)methoxy]benzamide (CID 7640045) is 2-[(4-bromo-2-fluorophenyl)methoxy]benzamide.
What is the SMILES notation for 2-[(4-bromo-2-fluorophenyl)methoxy]benzamide?
The canonical SMILES for 2-[(4-bromo-2-fluorophenyl)methoxy]benzamide is NC(=O)c1ccccc1OCc1ccc(Br)cc1F.
What is the InChIKey of 2-[(4-bromo-2-fluorophenyl)methoxy]benzamide?
The InChIKey is CTXBAPUOMRHLPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrFNO2/c15-10-6-5-9(12(16)7-10)8-19-13-4-2-1-3-11(13)14(17)18/h1-7H,8H2,(H2,17,18).
What are the key properties of 2-[(4-bromo-2-fluorophenyl)methoxy]benzamide?
2-[(4-bromo-2-fluorophenyl)methoxy]benzamide has a molecular weight of 324.15 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-bromo-2-fluorophenyl)methoxy]benzamide is sourced from PubChem (CID 7640045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).