1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene

C26H20 — CID 71399192

IUPAC1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene
SMILESC(=Cc1ccccc1C=Cc1cccc2ccccc12)c1ccccc1
InChIInChI=1S/C26H20/c1-2-9-21(10-3-1)17-18-22-11-4-5-12-23(22)19-20-25-15-8-14-24-13-6-7-16-26(24)25/h1-20H
InChIKeyYSHUQJMRWQFKGM-UHFFFAOYSA-N
MW332.45 g/mol
LogP7.18
Rot. Bonds4

About 1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene

1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene (PubChem CID 71399192) has the molecular formula C26H20 and a molecular weight of 332.45 g/mol. Its IUPAC name is 1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene.

Molecular Properties

Compound Name1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene
PubChem CID71399192
Molecular FormulaC26H20
Molecular Weight332.45 g/mol
Exact Mass332.16
IUPAC Name1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene
SMILESC(=Cc1ccccc1C=Cc1cccc2ccccc12)c1ccccc1
InChIInChI=1S/C26H20/c1-2-9-21(10-3-1)17-18-22-11-4-5-12-23(22)19-20-25-15-8-14-24-13-6-7-16-26(24)25/h1-20H
InChIKeyYSHUQJMRWQFKGM-UHFFFAOYSA-N
XLogP7.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.45
LogP ≤ 57.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-[(E)-2-[4-[(E)-2-naphthalen-1-ylethenyl]phenyl]ethenyl]naphthalene
CID 139196261
4-[(E)-2-naphthalen-1-ylethenyl]pyridine
CID 5475238
1-[2-(4-chlorophenyl)ethenyl]naphthalene
CID 85443671
tris[4-[(E)-2-naphthalen-1-ylethenyl]phenyl]phosphane
CID 58942116
1-[2-[2,4,5-tris(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene
CID 139835020
bis(1,2-bis[(E)-2-phenylethenyl]benzene);sulfane
CID 68618408
2-(2-phenylethenyl)-1-[2-(2-phenylethenyl)naphthalen-1-yl]oxynaphthalene
CID 68718869
2-naphthalen-1-ylethenamine
CID 69243468
1-(2-bromoethenyl)naphthalene
CID 71403351
1-methylnaphthalene;stilbene
CID 173370087
2-[4-(2-naphthalen-1-ylethenyl)pyridin-1-ium-1-yl]acetic acid bromide
CID 20981637
CID 67900431
CID 67900431

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene?
The IUPAC name of 1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene (CID 71399192) is 1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene.
What is the SMILES notation for 1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene?
The canonical SMILES for 1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene is C(=Cc1ccccc1C=Cc1cccc2ccccc12)c1ccccc1.
What is the InChIKey of 1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene?
The InChIKey is YSHUQJMRWQFKGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20/c1-2-9-21(10-3-1)17-18-22-11-4-5-12-23(22)19-20-25-15-8-14-24-13-6-7-16-26(24)25/h1-20H.
What are the key properties of 1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene?
1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene has a molecular weight of 332.45 g/mol, XLogP of 7.18, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene is sourced from PubChem (CID 71399192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).