4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide

C14H8ClFN2O2 — CID 62316486

IUPAC4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide
SMILESN#Cc1cc(NC(=O)c2ccc(Cl)cc2O)ccc1F
InChIInChI=1S/C14H8ClFN2O2/c15-9-1-3-11(13(19)6-9)14(20)18-10-2-4-12(16)8(5-10)7-17/h1-6,19H,(H,18,20)
InChIKeyXCOSSQCTQKELRT-UHFFFAOYSA-N
MW290.68 g/mol
LogP3.31
Rot. Bonds2

About 4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide

4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide (PubChem CID 62316486) has the molecular formula C14H8ClFN2O2 and a molecular weight of 290.68 g/mol. Its IUPAC name is 4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide.

Molecular Properties

Compound Name4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide
PubChem CID62316486
Molecular FormulaC14H8ClFN2O2
Molecular Weight290.68 g/mol
Exact Mass290.03
IUPAC Name4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide
SMILESN#Cc1cc(NC(=O)c2ccc(Cl)cc2O)ccc1F
InChIInChI=1S/C14H8ClFN2O2/c15-9-1-3-11(13(19)6-9)14(20)18-10-2-4-12(16)8(5-10)7-17/h1-6,19H,(H,18,20)
InChIKeyXCOSSQCTQKELRT-UHFFFAOYSA-N
XLogP3.31
TPSA73.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.68
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-cyano-4-fluorophenyl)-2,3-dihydroxybenzamide
CID 114343561
N-(3-cyano-4-fluorophenyl)-4-fluoro-2-methylbenzamide
CID 115745574
5-amino-N-(3-cyano-4-fluorophenyl)-2-methylbenzamide
CID 62318012
2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide
CID 103763591
2-amino-5-chloro-N-(3,4-dicyanophenyl)benzamide
CID 107786836
5-chloro-N-(3-cyano-4-fluorophenyl)-2-(methylamino)pyridine-4-carboxamide
CID 114923271
N-(4-chloro-3-cyanophenyl)-2-fluoro-5-methylbenzamide
CID 62510457
2-bromo-N-(3-cyano-4-fluorophenyl)-5-methylbenzamide
CID 81004502
2-(4-chlorophenyl)-N-(3-cyano-4-fluorophenyl)acetamide
CID 62316311
3-bromo-N-(3-cyano-4-fluorophenyl)-4-fluorobenzamide
CID 103707295
2-amino-4-chloro-N-(3-chloro-4-cyanophenyl)benzamide
CID 43168358
N-(3-cyano-4-fluorophenyl)-6-fluoropyridine-2-carboxamide
CID 113323580

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide?
The IUPAC name of 4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide (CID 62316486) is 4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide.
What is the SMILES notation for 4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide?
The canonical SMILES for 4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide is N#Cc1cc(NC(=O)c2ccc(Cl)cc2O)ccc1F.
What is the InChIKey of 4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide?
The InChIKey is XCOSSQCTQKELRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8ClFN2O2/c15-9-1-3-11(13(19)6-9)14(20)18-10-2-4-12(16)8(5-10)7-17/h1-6,19H,(H,18,20).
What are the key properties of 4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide?
4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide has a molecular weight of 290.68 g/mol, XLogP of 3.31, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide is sourced from PubChem (CID 62316486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).