N-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide

C14H8BrClN2O2 — CID 107791108

IUPACN-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide
SMILESN#Cc1ccc(NC(=O)c2ccc(O)c(Cl)c2)c(Br)c1
InChIInChI=1S/C14H8BrClN2O2/c15-10-5-8(7-17)1-3-12(10)18-14(20)9-2-4-13(19)11(16)6-9/h1-6,19H,(H,18,20)
InChIKeyALUJVPGRLXBODA-UHFFFAOYSA-N
MW351.59 g/mol
LogP3.93
Rot. Bonds2

About N-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide

N-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide (PubChem CID 107791108) has the molecular formula C14H8BrClN2O2 and a molecular weight of 351.59 g/mol. Its IUPAC name is N-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide.

Molecular Properties

Compound NameN-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide
PubChem CID107791108
Molecular FormulaC14H8BrClN2O2
Molecular Weight351.59 g/mol
Exact Mass349.95
IUPAC NameN-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide
SMILESN#Cc1ccc(NC(=O)c2ccc(O)c(Cl)c2)c(Br)c1
InChIInChI=1S/C14H8BrClN2O2/c15-10-5-8(7-17)1-3-12(10)18-14(20)9-2-4-13(19)11(16)6-9/h1-6,19H,(H,18,20)
InChIKeyALUJVPGRLXBODA-UHFFFAOYSA-N
XLogP3.93
TPSA73.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.59
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-N-(2-bromo-4-cyanophenyl)-4-chlorobenzamide
CID 103841848
N-(2-bromo-4-chlorophenyl)-3-chloro-4-hydroxybenzamide
CID 81271353
N-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide
CID 28938603
3-chloro-N-(2-cyano-4-fluorophenyl)-4-hydroxybenzamide
CID 82015912
N-(2-bromo-4-cyanophenyl)-2,3-dihydro-1H-isoindole-5-carboxamide
CID 103998397
N-(2-bromo-4-cyanophenyl)-5-chlorofuran-2-carboxamide
CID 113231347
N-(4-amino-2-bromophenyl)-4-cyanobenzamide
CID 43549549
N-(2-bromo-4-cyanophenyl)-1H-pyrazole-4-carboxamide
CID 61259361
3-bromo-N-(2-bromo-4-cyanophenyl)-5-methylbenzamide
CID 104852225
4-chloro-N-(2-chloro-4-cyanophenyl)benzamide
CID 103799745
5-amino-N-(2-bromo-4-cyanophenyl)-2,3-dichlorobenzamide
CID 107796812
3-chloro-N-(2-chloro-4-hydroxyphenyl)-4-hydroxybenzamide
CID 64787162

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide?
The IUPAC name of N-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide (CID 107791108) is N-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide.
What is the SMILES notation for N-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide?
The canonical SMILES for N-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide is N#Cc1ccc(NC(=O)c2ccc(O)c(Cl)c2)c(Br)c1.
What is the InChIKey of N-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide?
The InChIKey is ALUJVPGRLXBODA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8BrClN2O2/c15-10-5-8(7-17)1-3-12(10)18-14(20)9-2-4-13(19)11(16)6-9/h1-6,19H,(H,18,20).
What are the key properties of N-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide?
N-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide has a molecular weight of 351.59 g/mol, XLogP of 3.93, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide is sourced from PubChem (CID 107791108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).