2-bromo-5-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide

C14H11BrFNO2 — CID 47292162

IUPAC2-bromo-5-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide
SMILESO=C(NCc1cccc(O)c1)c1cc(F)ccc1Br
InChIInChI=1S/C14H11BrFNO2/c15-13-5-4-10(16)7-12(13)14(19)17-8-9-2-1-3-11(18)6-9/h1-7,18H,8H2,(H,17,19)
InChIKeyFUMVJQZGLHBDMT-UHFFFAOYSA-N
MW324.15 g/mol
LogP3.22
Rot. Bonds3

About 2-bromo-5-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide

2-bromo-5-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide (PubChem CID 47292162) has the molecular formula C14H11BrFNO2 and a molecular weight of 324.15 g/mol. Its IUPAC name is 2-bromo-5-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide.

Molecular Properties

Compound Name2-bromo-5-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide
PubChem CID47292162
Molecular FormulaC14H11BrFNO2
Molecular Weight324.15 g/mol
Exact Mass323.00
IUPAC Name2-bromo-5-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide
SMILESO=C(NCc1cccc(O)c1)c1cc(F)ccc1Br
InChIInChI=1S/C14H11BrFNO2/c15-13-5-4-10(16)7-12(13)14(19)17-8-9-2-1-3-11(18)6-9/h1-7,18H,8H2,(H,17,19)
InChIKeyFUMVJQZGLHBDMT-UHFFFAOYSA-N
XLogP3.22
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.15
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-4-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide
CID 47292077
2-bromo-5-fluoro-N-[(4-hydroxyphenyl)methyl]benzamide
CID 52560940
2,4-difluoro-N-[(3-hydroxyphenyl)methyl]benzamide
CID 47292194
2-bromo-5-fluoro-N-[(4-fluorophenyl)methyl]benzamide
CID 8927292
5-bromo-2-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide
CID 47292159
2-bromo-4-chloro-N-[(3-hydroxyphenyl)methyl]benzamide
CID 103765522
2-(4-fluorophenyl)-N-[(3-hydroxyphenyl)methyl]acetamide
CID 47292141
2-bromo-N-[(3-chlorophenyl)methyl]-4-fluorobenzamide
CID 9209881
2-bromo-N-[(4-carbamothioylphenyl)methyl]-5-fluorobenzamide
CID 62309631
2-bromo-5-methyl-N-[(3-methylphenyl)methyl]benzamide
CID 80979004
2-fluoro-N-[(3-hydroxyphenyl)methyl]-4-methylbenzamide
CID 79795606
4-bromo-N-[(3-fluorophenyl)methyl]-3-hydroxybenzamide
CID 103830502

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide?
The IUPAC name of 2-bromo-5-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide (CID 47292162) is 2-bromo-5-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide.
What is the SMILES notation for 2-bromo-5-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide?
The canonical SMILES for 2-bromo-5-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide is O=C(NCc1cccc(O)c1)c1cc(F)ccc1Br.
What is the InChIKey of 2-bromo-5-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide?
The InChIKey is FUMVJQZGLHBDMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrFNO2/c15-13-5-4-10(16)7-12(13)14(19)17-8-9-2-1-3-11(18)6-9/h1-7,18H,8H2,(H,17,19).
What are the key properties of 2-bromo-5-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide?
2-bromo-5-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide has a molecular weight of 324.15 g/mol, XLogP of 3.22, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-fluoro-N-[(3-hydroxyphenyl)methyl]benzamide is sourced from PubChem (CID 47292162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).