4-[2-(furan-2-yl)phenoxy]benzonitrile

C17H11NO2 — CID 168525428

IUPAC4-[2-(furan-2-yl)phenoxy]benzonitrile
SMILESN#Cc1ccc(Oc2ccccc2-c2ccco2)cc1
InChIInChI=1S/C17H11NO2/c18-12-13-7-9-14(10-8-13)20-17-5-2-1-4-15(17)16-6-3-11-19-16/h1-11H
InChIKeyPZEYGVPQUSHVCD-UHFFFAOYSA-N
MW261.28 g/mol
LogP4.61
Rot. Bonds3

About 4-[2-(furan-2-yl)phenoxy]benzonitrile

4-[2-(furan-2-yl)phenoxy]benzonitrile (PubChem CID 168525428) has the molecular formula C17H11NO2 and a molecular weight of 261.28 g/mol. Its IUPAC name is 4-[2-(furan-2-yl)phenoxy]benzonitrile.

Molecular Properties

Compound Name4-[2-(furan-2-yl)phenoxy]benzonitrile
PubChem CID168525428
Molecular FormulaC17H11NO2
Molecular Weight261.28 g/mol
Exact Mass261.08
IUPAC Name4-[2-(furan-2-yl)phenoxy]benzonitrile
SMILESN#Cc1ccc(Oc2ccccc2-c2ccco2)cc1
InChIInChI=1S/C17H11NO2/c18-12-13-7-9-14(10-8-13)20-17-5-2-1-4-15(17)16-6-3-11-19-16/h1-11H
InChIKeyPZEYGVPQUSHVCD-UHFFFAOYSA-N
XLogP4.61
TPSA46.16 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-phenoxyphenyl)furan
CID 173223033
2-[4-(2-chlorophenoxy)phenyl]furan
CID 168528835
2-(4-cyanophenoxy)-4-(furan-2-yl)-6-[(1Z)-1-sulfanylbuta-1,3-dienyl]pyridine-3-carbonitrile
CID 143568670
2-[2-(4-phenylphenoxy)-5-(trifluoromethyl)phenyl]furan
CID 168525850
4-[4-[9-[4-(4-cyanophenoxy)phenyl]fluoren-9-yl]phenoxy]benzonitrile
CID 16744152
4-(1,2-dioxoacenaphthylen-5-yl)oxybenzonitrile
CID 4558065
4-[4-(furan-2-yl)-6-phenyl-2-pyridinyl]benzonitrile
CID 122366103
4-[4-(1,3-dioxoisoindol-2-yl)phenoxy]benzonitrile
CID 765217
4-(3-methoxy-2-propan-2-ylphenoxy)benzonitrile
CID 69455787
4-[(4,6-diphenoxy-1,3,5-triazin-2-yl)oxy]benzonitrile
CID 162501099
2-fluoro-6-(furan-2-yl)benzonitrile
CID 114898559
4-(2,5-difluorophenoxy)benzonitrile
CID 63269334

Frequently Asked Questions

What is the IUPAC name of 4-[2-(furan-2-yl)phenoxy]benzonitrile?
The IUPAC name of 4-[2-(furan-2-yl)phenoxy]benzonitrile (CID 168525428) is 4-[2-(furan-2-yl)phenoxy]benzonitrile.
What is the SMILES notation for 4-[2-(furan-2-yl)phenoxy]benzonitrile?
The canonical SMILES for 4-[2-(furan-2-yl)phenoxy]benzonitrile is N#Cc1ccc(Oc2ccccc2-c2ccco2)cc1.
What is the InChIKey of 4-[2-(furan-2-yl)phenoxy]benzonitrile?
The InChIKey is PZEYGVPQUSHVCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11NO2/c18-12-13-7-9-14(10-8-13)20-17-5-2-1-4-15(17)16-6-3-11-19-16/h1-11H.
What are the key properties of 4-[2-(furan-2-yl)phenoxy]benzonitrile?
4-[2-(furan-2-yl)phenoxy]benzonitrile has a molecular weight of 261.28 g/mol, XLogP of 4.61, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(furan-2-yl)phenoxy]benzonitrile is sourced from PubChem (CID 168525428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).