1-methyl-4-(2-phenylethenyl)naphthalene

C19H16 — CID 4283155

IUPAC1-methyl-4-(2-phenylethenyl)naphthalene
SMILESCc1ccc(C=Cc2ccccc2)c2ccccc12
InChIInChI=1S/C19H16/c1-15-11-13-17(19-10-6-5-9-18(15)19)14-12-16-7-3-2-4-8-16/h2-14H,1H3
InChIKeyTXBVIPPORYAHLK-UHFFFAOYSA-N
MW244.34 g/mol
LogP5.32
Rot. Bonds2

About 1-methyl-4-(2-phenylethenyl)naphthalene

1-methyl-4-(2-phenylethenyl)naphthalene (PubChem CID 4283155) has the molecular formula C19H16 and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-methyl-4-(2-phenylethenyl)naphthalene.

Molecular Properties

Compound Name1-methyl-4-(2-phenylethenyl)naphthalene
PubChem CID4283155
Molecular FormulaC19H16
Molecular Weight244.34 g/mol
Exact Mass244.13
IUPAC Name1-methyl-4-(2-phenylethenyl)naphthalene
SMILESCc1ccc(C=Cc2ccccc2)c2ccccc12
InChIInChI=1S/C19H16/c1-15-11-13-17(19-10-6-5-9-18(15)19)14-12-16-7-3-2-4-8-16/h2-14H,1H3
InChIKeyTXBVIPPORYAHLK-UHFFFAOYSA-N
XLogP5.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500244.34
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(2-phenylethenyl)naphthalene?
The IUPAC name of 1-methyl-4-(2-phenylethenyl)naphthalene (CID 4283155) is 1-methyl-4-(2-phenylethenyl)naphthalene.
What is the SMILES notation for 1-methyl-4-(2-phenylethenyl)naphthalene?
The canonical SMILES for 1-methyl-4-(2-phenylethenyl)naphthalene is Cc1ccc(C=Cc2ccccc2)c2ccccc12.
What is the InChIKey of 1-methyl-4-(2-phenylethenyl)naphthalene?
The InChIKey is TXBVIPPORYAHLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16/c1-15-11-13-17(19-10-6-5-9-18(15)19)14-12-16-7-3-2-4-8-16/h2-14H,1H3.
What are the key properties of 1-methyl-4-(2-phenylethenyl)naphthalene?
1-methyl-4-(2-phenylethenyl)naphthalene has a molecular weight of 244.34 g/mol, XLogP of 5.32, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(2-phenylethenyl)naphthalene is sourced from PubChem (CID 4283155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).