4-(2-fluorophenoxy)pyridine-2-carbonitrile

C12H7FN2O — CID 62936070

IUPAC4-(2-fluorophenoxy)pyridine-2-carbonitrile
SMILESN#Cc1cc(Oc2ccccc2F)ccn1
InChIInChI=1S/C12H7FN2O/c13-11-3-1-2-4-12(11)16-10-5-6-15-9(7-10)8-14/h1-7H
InChIKeyAFUUKAMKNBCMGM-UHFFFAOYSA-N
MW214.20 g/mol
LogP2.88
Rot. Bonds2

About 4-(2-fluorophenoxy)pyridine-2-carbonitrile

4-(2-fluorophenoxy)pyridine-2-carbonitrile (PubChem CID 62936070) has the molecular formula C12H7FN2O and a molecular weight of 214.20 g/mol. Its IUPAC name is 4-(2-fluorophenoxy)pyridine-2-carbonitrile.

Molecular Properties

Compound Name4-(2-fluorophenoxy)pyridine-2-carbonitrile
PubChem CID62936070
Molecular FormulaC12H7FN2O
Molecular Weight214.20 g/mol
Exact Mass214.05
IUPAC Name4-(2-fluorophenoxy)pyridine-2-carbonitrile
SMILESN#Cc1cc(Oc2ccccc2F)ccn1
InChIInChI=1S/C12H7FN2O/c13-11-3-1-2-4-12(11)16-10-5-6-15-9(7-10)8-14/h1-7H
InChIKeyAFUUKAMKNBCMGM-UHFFFAOYSA-N
XLogP2.88
TPSA45.91 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.20
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenoxy)pyridine-2-carbonitrile?
The IUPAC name of 4-(2-fluorophenoxy)pyridine-2-carbonitrile (CID 62936070) is 4-(2-fluorophenoxy)pyridine-2-carbonitrile.
What is the SMILES notation for 4-(2-fluorophenoxy)pyridine-2-carbonitrile?
The canonical SMILES for 4-(2-fluorophenoxy)pyridine-2-carbonitrile is N#Cc1cc(Oc2ccccc2F)ccn1.
What is the InChIKey of 4-(2-fluorophenoxy)pyridine-2-carbonitrile?
The InChIKey is AFUUKAMKNBCMGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7FN2O/c13-11-3-1-2-4-12(11)16-10-5-6-15-9(7-10)8-14/h1-7H.
What are the key properties of 4-(2-fluorophenoxy)pyridine-2-carbonitrile?
4-(2-fluorophenoxy)pyridine-2-carbonitrile has a molecular weight of 214.20 g/mol, XLogP of 2.88, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenoxy)pyridine-2-carbonitrile is sourced from PubChem (CID 62936070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).