1-[2-[2-methyl-4-(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene

C31H24 — CID 71388289

IUPAC1-[2-[2-methyl-4-(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene
SMILESCc1cc(C=Cc2cccc3ccccc23)ccc1C=Cc1cccc2ccccc12
InChIInChI=1S/C31H24/c1-23-22-24(17-19-28-12-6-10-26-8-2-4-14-30(26)28)16-18-25(23)20-21-29-13-7-11-27-9-3-5-15-31(27)29/h2-22H,1H3
InChIKeyVVNQANXUYOJGDN-UHFFFAOYSA-N
MW396.53 g/mol
LogP8.64
Rot. Bonds4

About 1-[2-[2-methyl-4-(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene

1-[2-[2-methyl-4-(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene (PubChem CID 71388289) has the molecular formula C31H24 and a molecular weight of 396.53 g/mol. Its IUPAC name is 1-[2-[2-methyl-4-(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene.

Molecular Properties

Compound Name1-[2-[2-methyl-4-(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene
PubChem CID71388289
Molecular FormulaC31H24
Molecular Weight396.53 g/mol
Exact Mass396.19
IUPAC Name1-[2-[2-methyl-4-(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene
SMILESCc1cc(C=Cc2cccc3ccccc23)ccc1C=Cc1cccc2ccccc12
InChIInChI=1S/C31H24/c1-23-22-24(17-19-28-12-6-10-26-8-2-4-14-30(26)28)16-18-25(23)20-21-29-13-7-11-27-9-3-5-15-31(27)29/h2-22H,1H3
InChIKeyVVNQANXUYOJGDN-UHFFFAOYSA-N
XLogP8.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.53
LogP ≤ 58.64
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
1-[2-(3-bicyclo[4.2.0]octa-1(6),2,4,7-tetraenyl)ethenyl]naphthalene
CID 54574596
1-[2-[2,4,5-tris(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene
CID 139835020
2-methyl-5-[(E)-2-naphthalen-1-ylethenyl]pyridine
CID 6011457
1-[2-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)ethenyl]naphthalene
CID 54443966
1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene
CID 6253992
1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene
CID 71399192
1-[2-(4-chlorophenyl)ethenyl]naphthalene
CID 85443671
4-methyl-N-(4-methylphenyl)-N-[4-[(E)-2-naphthalen-1-ylethenyl]phenyl]aniline
CID 58933310
tris[4-[(E)-2-naphthalen-1-ylethenyl]phenyl]phosphane
CID 58942116
1,8-bis[2-[4-(2,2-diphenylethenyl)-3-methylphenyl]ethenyl]naphthalene
CID 59100453
4-methyl-2,6-bis(2-naphthalen-1-ylethenyl)pyridine
CID 67805142

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-methyl-4-(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene?
The IUPAC name of 1-[2-[2-methyl-4-(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene (CID 71388289) is 1-[2-[2-methyl-4-(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene.
What is the SMILES notation for 1-[2-[2-methyl-4-(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene?
The canonical SMILES for 1-[2-[2-methyl-4-(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene is Cc1cc(C=Cc2cccc3ccccc23)ccc1C=Cc1cccc2ccccc12.
What is the InChIKey of 1-[2-[2-methyl-4-(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene?
The InChIKey is VVNQANXUYOJGDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24/c1-23-22-24(17-19-28-12-6-10-26-8-2-4-14-30(26)28)16-18-25(23)20-21-29-13-7-11-27-9-3-5-15-31(27)29/h2-22H,1H3.
What are the key properties of 1-[2-[2-methyl-4-(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene?
1-[2-[2-methyl-4-(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene has a molecular weight of 396.53 g/mol, XLogP of 8.64, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-methyl-4-(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene is sourced from PubChem (CID 71388289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).