N-(4-bromo-2-cyanophenyl)-4-fluoro-2-hydroxybenzamide

C14H8BrFN2O2 — CID 107014840

IUPACN-(4-bromo-2-cyanophenyl)-4-fluoro-2-hydroxybenzamide
SMILESN#Cc1cc(Br)ccc1NC(=O)c1ccc(F)cc1O
InChIInChI=1S/C14H8BrFN2O2/c15-9-1-4-12(8(5-9)7-17)18-14(20)11-3-2-10(16)6-13(11)19/h1-6,19H,(H,18,20)
InChIKeyDRDHGRBZDWYAEV-UHFFFAOYSA-N
MW335.13 g/mol
LogP3.42
Rot. Bonds2

About N-(4-bromo-2-cyanophenyl)-4-fluoro-2-hydroxybenzamide

N-(4-bromo-2-cyanophenyl)-4-fluoro-2-hydroxybenzamide (PubChem CID 107014840) has the molecular formula C14H8BrFN2O2 and a molecular weight of 335.13 g/mol. Its IUPAC name is N-(4-bromo-2-cyanophenyl)-4-fluoro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(4-bromo-2-cyanophenyl)-4-fluoro-2-hydroxybenzamide
PubChem CID107014840
Molecular FormulaC14H8BrFN2O2
Molecular Weight335.13 g/mol
Exact Mass333.98
IUPAC NameN-(4-bromo-2-cyanophenyl)-4-fluoro-2-hydroxybenzamide
SMILESN#Cc1cc(Br)ccc1NC(=O)c1ccc(F)cc1O
InChIInChI=1S/C14H8BrFN2O2/c15-9-1-4-12(8(5-9)7-17)18-14(20)11-3-2-10(16)6-13(11)19/h1-6,19H,(H,18,20)
InChIKeyDRDHGRBZDWYAEV-UHFFFAOYSA-N
XLogP3.42
TPSA73.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.13
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-N-(4-bromo-2-cyanophenyl)-2-sulfanylbenzamide
CID 107033617
2,4-diamino-N-(4-bromo-2-cyanophenyl)benzamide
CID 82702808
N-(2-cyano-4-fluorophenyl)-2,5-dihydroxybenzamide
CID 107722029
2-bromo-5-chloro-N-(2-cyano-4-fluorophenyl)benzamide
CID 103739886
2-bromo-N-(4-bromo-2-cyanophenyl)-5-sulfanylbenzamide
CID 107033611
N-(4-amino-2-cyanophenyl)-2,5-dibromobenzamide
CID 114367683
N-(4-bromo-2-cyanophenyl)-4-hydroxy-3-methylbenzamide
CID 107675930
N-(4-bromo-2-cyanophenyl)-4-cyanobenzamide
CID 81498291
2-amino-5-bromo-N-(4-bromo-2-cyanophenyl)pyridine-3-carboxamide
CID 82703881
5-amino-N-(4-bromo-2-cyanophenyl)-2,3-dichlorobenzamide
CID 107185689
N-(5-bromo-2-cyanophenyl)-2-hydroxy-4-methoxybenzamide
CID 104880346
(4-bromo-2-cyanophenyl)urea
CID 82708837

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2-cyanophenyl)-4-fluoro-2-hydroxybenzamide?
The IUPAC name of N-(4-bromo-2-cyanophenyl)-4-fluoro-2-hydroxybenzamide (CID 107014840) is N-(4-bromo-2-cyanophenyl)-4-fluoro-2-hydroxybenzamide.
What is the SMILES notation for N-(4-bromo-2-cyanophenyl)-4-fluoro-2-hydroxybenzamide?
The canonical SMILES for N-(4-bromo-2-cyanophenyl)-4-fluoro-2-hydroxybenzamide is N#Cc1cc(Br)ccc1NC(=O)c1ccc(F)cc1O.
What is the InChIKey of N-(4-bromo-2-cyanophenyl)-4-fluoro-2-hydroxybenzamide?
The InChIKey is DRDHGRBZDWYAEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8BrFN2O2/c15-9-1-4-12(8(5-9)7-17)18-14(20)11-3-2-10(16)6-13(11)19/h1-6,19H,(H,18,20).
What are the key properties of N-(4-bromo-2-cyanophenyl)-4-fluoro-2-hydroxybenzamide?
N-(4-bromo-2-cyanophenyl)-4-fluoro-2-hydroxybenzamide has a molecular weight of 335.13 g/mol, XLogP of 3.42, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2-cyanophenyl)-4-fluoro-2-hydroxybenzamide is sourced from PubChem (CID 107014840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).