1-naphthalen-1-ylnaphthalene

C20H14 — CID 11789

IUPAC1-naphthalen-1-ylnaphthalene
SMILESc1ccc2c(-c3cccc4ccccc34)cccc2c1
InChIInChI=1S/C20H14/c1-3-11-17-15(7-1)9-5-13-19(17)20-14-6-10-16-8-2-4-12-18(16)20/h1-14H
InChIKeyZDZHCHYQNPQSGG-UHFFFAOYSA-N
MW254.33 g/mol
LogP5.66
Rot. Bonds1

About 1-naphthalen-1-ylnaphthalene

1-naphthalen-1-ylnaphthalene (PubChem CID 11789) has the molecular formula C20H14 and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-naphthalen-1-ylnaphthalene.

Molecular Properties

Compound Name1-naphthalen-1-ylnaphthalene
PubChem CID11789
Molecular FormulaC20H14
Molecular Weight254.33 g/mol
Exact Mass254.11
IUPAC Name1-naphthalen-1-ylnaphthalene
SMILESc1ccc2c(-c3cccc4ccccc34)cccc2c1
InChIInChI=1S/C20H14/c1-3-11-17-15(7-1)9-5-13-19(17)20-14-6-10-16-8-2-4-12-18(16)20/h1-14H
InChIKeyZDZHCHYQNPQSGG-UHFFFAOYSA-N
XLogP5.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.33
LogP ≤ 55.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-1-ylnaphthalene?
The IUPAC name of 1-naphthalen-1-ylnaphthalene (CID 11789) is 1-naphthalen-1-ylnaphthalene.
What is the SMILES notation for 1-naphthalen-1-ylnaphthalene?
The canonical SMILES for 1-naphthalen-1-ylnaphthalene is c1ccc2c(-c3cccc4ccccc34)cccc2c1.
What is the InChIKey of 1-naphthalen-1-ylnaphthalene?
The InChIKey is ZDZHCHYQNPQSGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14/c1-3-11-17-15(7-1)9-5-13-19(17)20-14-6-10-16-8-2-4-12-18(16)20/h1-14H.
What are the key properties of 1-naphthalen-1-ylnaphthalene?
1-naphthalen-1-ylnaphthalene has a molecular weight of 254.33 g/mol, XLogP of 5.66, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-1-ylnaphthalene is sourced from PubChem (CID 11789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).