3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide

C13H8Cl2FNO2 — CID 107366859

IUPAC3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide
SMILESO=C(Nc1cc(F)cc(Cl)c1)c1ccc(O)c(Cl)c1
InChIInChI=1S/C13H8Cl2FNO2/c14-8-4-9(16)6-10(5-8)17-13(19)7-1-2-12(18)11(15)3-7/h1-6,18H,(H,17,19)
InChIKeyPVNMURNHLJBXGP-UHFFFAOYSA-N
MW300.12 g/mol
LogP4.09
Rot. Bonds2

About 3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide

3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide (PubChem CID 107366859) has the molecular formula C13H8Cl2FNO2 and a molecular weight of 300.12 g/mol. Its IUPAC name is 3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide.

Molecular Properties

Compound Name3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide
PubChem CID107366859
Molecular FormulaC13H8Cl2FNO2
Molecular Weight300.12 g/mol
Exact Mass298.99
IUPAC Name3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide
SMILESO=C(Nc1cc(F)cc(Cl)c1)c1ccc(O)c(Cl)c1
InChIInChI=1S/C13H8Cl2FNO2/c14-8-4-9(16)6-10(5-8)17-13(19)7-1-2-12(18)11(15)3-7/h1-6,18H,(H,17,19)
InChIKeyPVNMURNHLJBXGP-UHFFFAOYSA-N
XLogP4.09
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.12
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chloro-5-fluorophenyl)-3-hydroxybenzamide
CID 107366818
4-amino-N-(3-chloro-5-fluorophenyl)-3-methylbenzamide
CID 107363413
N-(3-chloro-5-fluorophenyl)-2,5-dihydroxybenzamide
CID 107724034
3-chloro-N-(4-chloro-3-hydroxyphenyl)-4-hydroxybenzamide
CID 64788669
N-(3-chloro-5-fluorophenyl)-4-nitrobenzamide
CID 135306683
N-(3-chloro-5-fluorophenyl)-2-fluoro-6-hydroxybenzamide
CID 107366833
3-amino-N-(3-chloro-5-fluorophenyl)-4-methoxybenzamide
CID 107363446
3-chloro-4-hydroxy-N-thiophen-3-ylbenzamide
CID 64988130
3-bromo-4-chloro-N-(3,5-difluorophenyl)benzamide
CID 114025876
4-bromo-N-(3-chloro-5-fluorophenyl)-3-nitrobenzamide
CID 103774675
3-bromo-N-(3-chloro-4-hydroxyphenyl)-5-fluorobenzamide
CID 63935702
N-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide
CID 28938603

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide?
The IUPAC name of 3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide (CID 107366859) is 3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide.
What is the SMILES notation for 3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide?
The canonical SMILES for 3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide is O=C(Nc1cc(F)cc(Cl)c1)c1ccc(O)c(Cl)c1.
What is the InChIKey of 3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide?
The InChIKey is PVNMURNHLJBXGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl2FNO2/c14-8-4-9(16)6-10(5-8)17-13(19)7-1-2-12(18)11(15)3-7/h1-6,18H,(H,17,19).
What are the key properties of 3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide?
3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide has a molecular weight of 300.12 g/mol, XLogP of 4.09, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(3-chloro-5-fluorophenyl)-4-hydroxybenzamide is sourced from PubChem (CID 107366859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).