(2-amino-5-cyanophenyl) hypofluorite

C7H5FN2O — CID 142393314

IUPAC(2-amino-5-cyanophenyl) hypofluorite
SMILESN#Cc1ccc(N)c(OF)c1
InChIInChI=1S/C7H5FN2O/c8-11-7-3-5(4-9)1-2-6(7)10/h1-3H,10H2
InChIKeyRWBAREGWKPWVJB-UHFFFAOYSA-N
MW152.13 g/mol
LogP1.40
Rot. Bonds1

About (2-amino-5-cyanophenyl) hypofluorite

(2-amino-5-cyanophenyl) hypofluorite (PubChem CID 142393314) has the molecular formula C7H5FN2O and a molecular weight of 152.13 g/mol. Its IUPAC name is (2-amino-5-cyanophenyl) hypofluorite.

Molecular Properties

Compound Name(2-amino-5-cyanophenyl) hypofluorite
PubChem CID142393314
Molecular FormulaC7H5FN2O
Molecular Weight152.13 g/mol
Exact Mass152.04
IUPAC Name(2-amino-5-cyanophenyl) hypofluorite
SMILESN#Cc1ccc(N)c(OF)c1
InChIInChI=1S/C7H5FN2O/c8-11-7-3-5(4-9)1-2-6(7)10/h1-3H,10H2
InChIKeyRWBAREGWKPWVJB-UHFFFAOYSA-N
XLogP1.40
TPSA59.04 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.13
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-amino-3-cyclobutyloxybenzonitrile
CID 112623559
4-amino-3-[4-(trifluoromethyl)phenoxy]benzonitrile
CID 104712583
4-amino-3-(2-chloro-4-fluorophenoxy)benzonitrile
CID 104712633
4-amino-3-fluorobenzonitrile;methane
CID 174516091
4-amino-3-(2-methoxyphenoxy)benzonitrile
CID 113444296
4-amino-3-(4-bromo-3-fluorophenoxy)benzonitrile
CID 113444333
4-amino-3-[(2-fluorophenyl)methoxy]benzonitrile
CID 113444327
4-amino-3-(2,5-dimethylphenoxy)benzonitrile
CID 113444292
4-amino-3-methylbenzonitrile
CID 7010316
4-amino-3-iodobenzonitrile;hydroiodide
CID 161496000
4-amino-3-(furan-2-ylmethoxy)benzonitrile
CID 104712381
4-amino-3-hydroxybenzonitrile;hydrochloride
CID 57364476

Frequently Asked Questions

What is the IUPAC name of (2-amino-5-cyanophenyl) hypofluorite?
The IUPAC name of (2-amino-5-cyanophenyl) hypofluorite (CID 142393314) is (2-amino-5-cyanophenyl) hypofluorite.
What is the SMILES notation for (2-amino-5-cyanophenyl) hypofluorite?
The canonical SMILES for (2-amino-5-cyanophenyl) hypofluorite is N#Cc1ccc(N)c(OF)c1.
What is the InChIKey of (2-amino-5-cyanophenyl) hypofluorite?
The InChIKey is RWBAREGWKPWVJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5FN2O/c8-11-7-3-5(4-9)1-2-6(7)10/h1-3H,10H2.
What are the key properties of (2-amino-5-cyanophenyl) hypofluorite?
(2-amino-5-cyanophenyl) hypofluorite has a molecular weight of 152.13 g/mol, XLogP of 1.40, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-5-cyanophenyl) hypofluorite is sourced from PubChem (CID 142393314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).