2-(2-naphthalen-2-ylethenyl)benzonitrile

C19H13N — CID 54316772

IUPAC2-(2-naphthalen-2-ylethenyl)benzonitrile
SMILESN#Cc1ccccc1C=Cc1ccc2ccccc2c1
InChIInChI=1S/C19H13N/c20-14-19-8-4-2-6-17(19)12-10-15-9-11-16-5-1-3-7-18(16)13-15/h1-13H
InChIKeySOTTWNJJMHKZIG-UHFFFAOYSA-N
MW255.32 g/mol
LogP4.88
Rot. Bonds2

About 2-(2-naphthalen-2-ylethenyl)benzonitrile

2-(2-naphthalen-2-ylethenyl)benzonitrile (PubChem CID 54316772) has the molecular formula C19H13N and a molecular weight of 255.32 g/mol. Its IUPAC name is 2-(2-naphthalen-2-ylethenyl)benzonitrile.

Molecular Properties

Compound Name2-(2-naphthalen-2-ylethenyl)benzonitrile
PubChem CID54316772
Molecular FormulaC19H13N
Molecular Weight255.32 g/mol
Exact Mass255.10
IUPAC Name2-(2-naphthalen-2-ylethenyl)benzonitrile
SMILESN#Cc1ccccc1C=Cc1ccc2ccccc2c1
InChIInChI=1S/C19H13N/c20-14-19-8-4-2-6-17(19)12-10-15-9-11-16-5-1-3-7-18(16)13-15/h1-13H
InChIKeySOTTWNJJMHKZIG-UHFFFAOYSA-N
XLogP4.88
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-naphthalen-2-ylethenyl)benzonitrile?
The IUPAC name of 2-(2-naphthalen-2-ylethenyl)benzonitrile (CID 54316772) is 2-(2-naphthalen-2-ylethenyl)benzonitrile.
What is the SMILES notation for 2-(2-naphthalen-2-ylethenyl)benzonitrile?
The canonical SMILES for 2-(2-naphthalen-2-ylethenyl)benzonitrile is N#Cc1ccccc1C=Cc1ccc2ccccc2c1.
What is the InChIKey of 2-(2-naphthalen-2-ylethenyl)benzonitrile?
The InChIKey is SOTTWNJJMHKZIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N/c20-14-19-8-4-2-6-17(19)12-10-15-9-11-16-5-1-3-7-18(16)13-15/h1-13H.
What are the key properties of 2-(2-naphthalen-2-ylethenyl)benzonitrile?
2-(2-naphthalen-2-ylethenyl)benzonitrile has a molecular weight of 255.32 g/mol, XLogP of 4.88, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-naphthalen-2-ylethenyl)benzonitrile is sourced from PubChem (CID 54316772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).