1-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalene

C20H18 — CID 14747501

IUPAC1-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalene
SMILESc1ccc2c(-c3ccc4c(c3)CCCC4)cccc2c1
InChIInChI=1S/C20H18/c1-2-8-17-14-18(13-12-15(17)6-1)20-11-5-9-16-7-3-4-10-19(16)20/h3-5,7,9-14H,1-2,6,8H2
InChIKeyFHNKVQJLEQOUBF-UHFFFAOYSA-N
MW258.36 g/mol
LogP5.39
Rot. Bonds1

About 1-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalene

1-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalene (PubChem CID 14747501) has the molecular formula C20H18 and a molecular weight of 258.36 g/mol. Its IUPAC name is 1-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalene.

Molecular Properties

Compound Name1-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalene
PubChem CID14747501
Molecular FormulaC20H18
Molecular Weight258.36 g/mol
Exact Mass258.14
IUPAC Name1-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalene
SMILESc1ccc2c(-c3ccc4c(c3)CCCC4)cccc2c1
InChIInChI=1S/C20H18/c1-2-8-17-14-18(13-12-15(17)6-1)20-11-5-9-16-7-3-4-10-19(16)20/h3-5,7,9-14H,1-2,6,8H2
InChIKeyFHNKVQJLEQOUBF-UHFFFAOYSA-N
XLogP5.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms20
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500258.36
LogP ≤ 55.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalene?
The IUPAC name of 1-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalene (CID 14747501) is 1-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalene.
What is the SMILES notation for 1-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalene?
The canonical SMILES for 1-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalene is c1ccc2c(-c3ccc4c(c3)CCCC4)cccc2c1.
What is the InChIKey of 1-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalene?
The InChIKey is FHNKVQJLEQOUBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18/c1-2-8-17-14-18(13-12-15(17)6-1)20-11-5-9-16-7-3-4-10-19(16)20/h3-5,7,9-14H,1-2,6,8H2.
What are the key properties of 1-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalene?
1-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalene has a molecular weight of 258.36 g/mol, XLogP of 5.39, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalene is sourced from PubChem (CID 14747501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).