N'-(2-fluorophenyl)benzenecarboximidamide

C13H11FN2 — CID 13280737

IUPACN'-(2-fluorophenyl)benzenecarboximidamide
SMILESN/C(=N\c1ccccc1F)c1ccccc1
InChIInChI=1S/C13H11FN2/c14-11-8-4-5-9-12(11)16-13(15)10-6-2-1-3-7-10/h1-9H,(H2,15,16)
InChIKeyBUJHJFWMEPURGW-UHFFFAOYSA-N
MW214.24 g/mol
LogP2.86
Rot. Bonds2

About N'-(2-fluorophenyl)benzenecarboximidamide

N'-(2-fluorophenyl)benzenecarboximidamide (PubChem CID 13280737) has the molecular formula C13H11FN2 and a molecular weight of 214.24 g/mol. Its IUPAC name is N'-(2-fluorophenyl)benzenecarboximidamide.

Molecular Properties

Compound NameN'-(2-fluorophenyl)benzenecarboximidamide
PubChem CID13280737
Molecular FormulaC13H11FN2
Molecular Weight214.24 g/mol
Exact Mass214.09
IUPAC NameN'-(2-fluorophenyl)benzenecarboximidamide
SMILESN/C(=N\c1ccccc1F)c1ccccc1
InChIInChI=1S/C13H11FN2/c14-11-8-4-5-9-12(11)16-13(15)10-6-2-1-3-7-10/h1-9H,(H2,15,16)
InChIKeyBUJHJFWMEPURGW-UHFFFAOYSA-N
XLogP2.86
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.24
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-(2-fluorophenyl)benzenecarboximidamide?
The IUPAC name of N'-(2-fluorophenyl)benzenecarboximidamide (CID 13280737) is N'-(2-fluorophenyl)benzenecarboximidamide.
What is the SMILES notation for N'-(2-fluorophenyl)benzenecarboximidamide?
The canonical SMILES for N'-(2-fluorophenyl)benzenecarboximidamide is N/C(=N\c1ccccc1F)c1ccccc1.
What is the InChIKey of N'-(2-fluorophenyl)benzenecarboximidamide?
The InChIKey is BUJHJFWMEPURGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2/c14-11-8-4-5-9-12(11)16-13(15)10-6-2-1-3-7-10/h1-9H,(H2,15,16).
What are the key properties of N'-(2-fluorophenyl)benzenecarboximidamide?
N'-(2-fluorophenyl)benzenecarboximidamide has a molecular weight of 214.24 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-fluorophenyl)benzenecarboximidamide is sourced from PubChem (CID 13280737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).