2-hydroxy-4-(2-phenylethenyl)benzonitrile

C15H11NO — CID 90919565

IUPAC2-hydroxy-4-(2-phenylethenyl)benzonitrile
SMILESN#Cc1ccc(C=Cc2ccccc2)cc1O
InChIInChI=1S/C15H11NO/c16-11-14-9-8-13(10-15(14)17)7-6-12-4-2-1-3-5-12/h1-10,17H
InChIKeyIUZNSOPUCAMDIV-UHFFFAOYSA-N
MW221.26 g/mol
LogP3.43
Rot. Bonds2

About 2-hydroxy-4-(2-phenylethenyl)benzonitrile

2-hydroxy-4-(2-phenylethenyl)benzonitrile (PubChem CID 90919565) has the molecular formula C15H11NO and a molecular weight of 221.26 g/mol. Its IUPAC name is 2-hydroxy-4-(2-phenylethenyl)benzonitrile.

Molecular Properties

Compound Name2-hydroxy-4-(2-phenylethenyl)benzonitrile
PubChem CID90919565
Molecular FormulaC15H11NO
Molecular Weight221.26 g/mol
Exact Mass221.08
IUPAC Name2-hydroxy-4-(2-phenylethenyl)benzonitrile
SMILESN#Cc1ccc(C=Cc2ccccc2)cc1O
InChIInChI=1S/C15H11NO/c16-11-14-9-8-13(10-15(14)17)7-6-12-4-2-1-3-5-12/h1-10,17H
InChIKeyIUZNSOPUCAMDIV-UHFFFAOYSA-N
XLogP3.43
TPSA44.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-hydroxy-4-phenylbenzonitrile
CID 23148964
2-chloro-5-(2-phenylethenyl)phenol
CID 174326276
2-methoxy-5-[(Z)-2-phenylethenyl]phenol
CID 6473980
2,4-dihydroxybenzonitrile
CID 3017520
2,5-bis[2-[4-(N-(4-hydroxyphenyl)anilino)phenyl]ethenyl]benzene-1,4-dicarbonitrile
CID 89337671
2-methyl-5-(2-phenylethenyl)benzene-1,3-diol
CID 68629496
4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]phenol
CID 52942315
4-[(E)-2-[4-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]phenyl]ethenyl]benzene-1,2-diol
CID 71680339
4-(2-phenylethenyl)phenol
CID 157400568
2,4-bis[(E)-2-phenylethenyl]benzene-1,3-dicarbonitrile
CID 22725864
2,5-bis[2-[4-(N-phenylanilino)phenyl]ethenyl]benzene-1,4-dicarbonitrile
CID 57074916
3-hydroxy-4-[(E)-3-phenylprop-2-enyl]benzonitrile
CID 162361494

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4-(2-phenylethenyl)benzonitrile?
The IUPAC name of 2-hydroxy-4-(2-phenylethenyl)benzonitrile (CID 90919565) is 2-hydroxy-4-(2-phenylethenyl)benzonitrile.
What is the SMILES notation for 2-hydroxy-4-(2-phenylethenyl)benzonitrile?
The canonical SMILES for 2-hydroxy-4-(2-phenylethenyl)benzonitrile is N#Cc1ccc(C=Cc2ccccc2)cc1O.
What is the InChIKey of 2-hydroxy-4-(2-phenylethenyl)benzonitrile?
The InChIKey is IUZNSOPUCAMDIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NO/c16-11-14-9-8-13(10-15(14)17)7-6-12-4-2-1-3-5-12/h1-10,17H.
What are the key properties of 2-hydroxy-4-(2-phenylethenyl)benzonitrile?
2-hydroxy-4-(2-phenylethenyl)benzonitrile has a molecular weight of 221.26 g/mol, XLogP of 3.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-4-(2-phenylethenyl)benzonitrile is sourced from PubChem (CID 90919565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).