4-(4-cyano-2-fluorophenoxy)benzamide

C14H9FN2O2 — CID 43657479

IUPAC4-(4-cyano-2-fluorophenoxy)benzamide
SMILESN#Cc1ccc(Oc2ccc(C(N)=O)cc2)c(F)c1
InChIInChI=1S/C14H9FN2O2/c15-12-7-9(8-16)1-6-13(12)19-11-4-2-10(3-5-11)14(17)18/h1-7H,(H2,17,18)
InChIKeyGNJMTMHEOVDKHX-UHFFFAOYSA-N
MW256.24 g/mol
LogP2.59
Rot. Bonds3

About 4-(4-cyano-2-fluorophenoxy)benzamide

4-(4-cyano-2-fluorophenoxy)benzamide (PubChem CID 43657479) has the molecular formula C14H9FN2O2 and a molecular weight of 256.24 g/mol. Its IUPAC name is 4-(4-cyano-2-fluorophenoxy)benzamide.

Molecular Properties

Compound Name4-(4-cyano-2-fluorophenoxy)benzamide
PubChem CID43657479
Molecular FormulaC14H9FN2O2
Molecular Weight256.24 g/mol
Exact Mass256.06
IUPAC Name4-(4-cyano-2-fluorophenoxy)benzamide
SMILESN#Cc1ccc(Oc2ccc(C(N)=O)cc2)c(F)c1
InChIInChI=1S/C14H9FN2O2/c15-12-7-9(8-16)1-6-13(12)19-11-4-2-10(3-5-11)14(17)18/h1-7H,(H2,17,18)
InChIKeyGNJMTMHEOVDKHX-UHFFFAOYSA-N
XLogP2.59
TPSA76.11 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.24
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3,4-diaminophenoxy)-3-fluorobenzonitrile
CID 107670075
3-fluoro-4-(4-hydroxyphenoxy)benzamide
CID 60870089
2-amino-4-(4-cyano-2-fluorophenoxy)benzoic acid
CID 107667496
4-[4-(2-aminoethyl)phenoxy]-3-fluorobenzonitrile
CID 65362371
4-(4-chloro-2-cyanophenoxy)benzamide
CID 62493065
4-(3-acetylphenoxy)-3-fluorobenzonitrile
CID 107665227
3-fluoro-4-[4-[(1S)-1-hydroxyethyl]phenoxy]benzonitrile
CID 107666062
3-fluoro-4-(4-formylphenoxy)benzamide
CID 57352536
4-[4-(cyanomethyl)phenoxy]-3-fluorobenzonitrile
CID 43657432
4-(3,4-dichlorophenoxy)-3-fluorobenzonitrile
CID 54897766
4-(2-cyanophenoxy)benzamide
CID 28825078
4-(4-bromo-2-fluorophenoxy)benzonitrile
CID 28876598

Frequently Asked Questions

What is the IUPAC name of 4-(4-cyano-2-fluorophenoxy)benzamide?
The IUPAC name of 4-(4-cyano-2-fluorophenoxy)benzamide (CID 43657479) is 4-(4-cyano-2-fluorophenoxy)benzamide.
What is the SMILES notation for 4-(4-cyano-2-fluorophenoxy)benzamide?
The canonical SMILES for 4-(4-cyano-2-fluorophenoxy)benzamide is N#Cc1ccc(Oc2ccc(C(N)=O)cc2)c(F)c1.
What is the InChIKey of 4-(4-cyano-2-fluorophenoxy)benzamide?
The InChIKey is GNJMTMHEOVDKHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9FN2O2/c15-12-7-9(8-16)1-6-13(12)19-11-4-2-10(3-5-11)14(17)18/h1-7H,(H2,17,18).
What are the key properties of 4-(4-cyano-2-fluorophenoxy)benzamide?
4-(4-cyano-2-fluorophenoxy)benzamide has a molecular weight of 256.24 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-cyano-2-fluorophenoxy)benzamide is sourced from PubChem (CID 43657479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).