N-(3,4-dicyanophenyl)-5-fluoro-2-hydroxybenzamide

C15H8FN3O2 — CID 103944404

IUPACN-(3,4-dicyanophenyl)-5-fluoro-2-hydroxybenzamide
SMILESN#Cc1ccc(NC(=O)c2cc(F)ccc2O)cc1C#N
InChIInChI=1S/C15H8FN3O2/c16-11-2-4-14(20)13(6-11)15(21)19-12-3-1-9(7-17)10(5-12)8-18/h1-6,20H,(H,19,21)
InChIKeyOMXRSNCYTDBDMV-UHFFFAOYSA-N
MW281.25 g/mol
LogP2.53
Rot. Bonds2

About N-(3,4-dicyanophenyl)-5-fluoro-2-hydroxybenzamide

N-(3,4-dicyanophenyl)-5-fluoro-2-hydroxybenzamide (PubChem CID 103944404) has the molecular formula C15H8FN3O2 and a molecular weight of 281.25 g/mol. Its IUPAC name is N-(3,4-dicyanophenyl)-5-fluoro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(3,4-dicyanophenyl)-5-fluoro-2-hydroxybenzamide
PubChem CID103944404
Molecular FormulaC15H8FN3O2
Molecular Weight281.25 g/mol
Exact Mass281.06
IUPAC NameN-(3,4-dicyanophenyl)-5-fluoro-2-hydroxybenzamide
SMILESN#Cc1ccc(NC(=O)c2cc(F)ccc2O)cc1C#N
InChIInChI=1S/C15H8FN3O2/c16-11-2-4-14(20)13(6-11)15(21)19-12-3-1-9(7-17)10(5-12)8-18/h1-6,20H,(H,19,21)
InChIKeyOMXRSNCYTDBDMV-UHFFFAOYSA-N
XLogP2.53
TPSA96.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.25
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-chloro-4-hydroxyphenyl)-5-fluoro-2-hydroxybenzamide
CID 115299202
N-(2-cyano-4-fluorophenyl)-2,5-dihydroxybenzamide
CID 107722029
N-(3-chloro-4-cyanophenyl)-5-fluoro-2-methoxybenzamide
CID 31115517
N-(3,4-dicyanophenyl)-3,5-dihydroxybenzamide
CID 103944403
3-chloro-N-(3,4-dicyanophenyl)-2-fluorobenzamide
CID 103774874
N-(3-cyano-4-fluorophenyl)-4-fluoro-2-methylbenzamide
CID 115745574
4-[(5-fluoro-2-hydroxybenzoyl)amino]-2-methylbenzoic acid
CID 115298490
N-(3-chloro-4-methylphenyl)-5-fluoro-2-hydroxybenzamide
CID 115298821
N-(3-ethynylphenyl)-5-fluoro-2-hydroxybenzamide
CID 79532349
5-fluoro-2-hydroxy-N-[4-[(Z)-N-hydroxy-C-methylcarbonimidoyl]phenyl]benzamide
CID 115298806
N-(3-cyano-4-fluorophenyl)-2,3-dihydroxybenzamide
CID 114343561
4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide
CID 62316486

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dicyanophenyl)-5-fluoro-2-hydroxybenzamide?
The IUPAC name of N-(3,4-dicyanophenyl)-5-fluoro-2-hydroxybenzamide (CID 103944404) is N-(3,4-dicyanophenyl)-5-fluoro-2-hydroxybenzamide.
What is the SMILES notation for N-(3,4-dicyanophenyl)-5-fluoro-2-hydroxybenzamide?
The canonical SMILES for N-(3,4-dicyanophenyl)-5-fluoro-2-hydroxybenzamide is N#Cc1ccc(NC(=O)c2cc(F)ccc2O)cc1C#N.
What is the InChIKey of N-(3,4-dicyanophenyl)-5-fluoro-2-hydroxybenzamide?
The InChIKey is OMXRSNCYTDBDMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8FN3O2/c16-11-2-4-14(20)13(6-11)15(21)19-12-3-1-9(7-17)10(5-12)8-18/h1-6,20H,(H,19,21).
What are the key properties of N-(3,4-dicyanophenyl)-5-fluoro-2-hydroxybenzamide?
N-(3,4-dicyanophenyl)-5-fluoro-2-hydroxybenzamide has a molecular weight of 281.25 g/mol, XLogP of 2.53, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dicyanophenyl)-5-fluoro-2-hydroxybenzamide is sourced from PubChem (CID 103944404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).