N-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide

C13H9Cl2NO3 — CID 3067488

IUPACN-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1O)c1ccccc1O
InChIInChI=1S/C13H9Cl2NO3/c14-7-5-9(15)12(18)10(6-7)16-13(19)8-3-1-2-4-11(8)17/h1-6,17-18H,(H,16,19)
InChIKeyOGGDKKRKBCZXHR-UHFFFAOYSA-N
MW298.12 g/mol
LogP3.66
Rot. Bonds2

About N-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide

N-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide (PubChem CID 3067488) has the molecular formula C13H9Cl2NO3 and a molecular weight of 298.12 g/mol. Its IUPAC name is N-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide
PubChem CID3067488
Molecular FormulaC13H9Cl2NO3
Molecular Weight298.12 g/mol
Exact Mass297.00
IUPAC NameN-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1O)c1ccccc1O
InChIInChI=1S/C13H9Cl2NO3/c14-7-5-9(15)12(18)10(6-7)16-13(19)8-3-1-2-4-11(8)17/h1-6,17-18H,(H,16,19)
InChIKeyOGGDKKRKBCZXHR-UHFFFAOYSA-N
XLogP3.66
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.12
LogP ≤ 53.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

2,5-dichloro-N-(3,5-dichloro-2-hydroxyphenyl)benzamide
CID 103891166
2-bromo-N-(3,5-dichloro-2-hydroxyphenyl)-3-methylbenzamide
CID 104625899
4-chloro-N-(3,5-dichloro-2-hydroxyphenyl)benzamide
CID 107675874
N-(2-chloro-5-methylphenyl)-2-hydroxybenzamide
CID 103769569
N-(3,5-dichloro-2-hydroxyphenyl)-4-hydroxy-3-methylbenzamide
CID 103958263
N-(3,5-dichloro-2-hydroxyphenyl)-1-benzofuran-2-carboxamide
CID 103891115
2,3,5-trichloro-N-(3,5-dichloro-2-hydroxyphenyl)-6-hydroxybenzamide
CID 21431939
N-[4-[(3,5-dichloro-2-hydroxyphenyl)methylideneamino]phenyl]-2-hydroxybenzamide
CID 2725439
1-(2-bromophenyl)-3-(3,5-dichloro-2-hydroxyphenyl)urea
CID 21184650
N-(3,5-dichloro-2-hydroxyphenyl)-3,5-dimethylbenzamide
CID 107675698
2-bromo-N-(3,5-dichloro-2-hydroxyphenyl)-6-fluorobenzamide
CID 103891179
N-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide
CID 772092

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide?
The IUPAC name of N-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide (CID 3067488) is N-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide.
What is the SMILES notation for N-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide?
The canonical SMILES for N-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide is O=C(Nc1cc(Cl)cc(Cl)c1O)c1ccccc1O.
What is the InChIKey of N-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide?
The InChIKey is OGGDKKRKBCZXHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Cl2NO3/c14-7-5-9(15)12(18)10(6-7)16-13(19)8-3-1-2-4-11(8)17/h1-6,17-18H,(H,16,19).
What are the key properties of N-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide?
N-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide has a molecular weight of 298.12 g/mol, XLogP of 3.66, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide is sourced from PubChem (CID 3067488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).