1-(2-methyl-1H-inden-5-yl)naphthalene

C20H16 — CID 54474031

IUPAC1-(2-methyl-1H-inden-5-yl)naphthalene
SMILESCC1=Cc2cc(-c3cccc4ccccc34)ccc2C1
InChIInChI=1S/C20H16/c1-14-11-16-9-10-17(13-18(16)12-14)20-8-4-6-15-5-2-3-7-19(15)20/h2-10,12-13H,11H2,1H3
InChIKeyNBZJLRFLLUSVNM-UHFFFAOYSA-N
MW256.35 g/mol
LogP5.47
Rot. Bonds1

About 1-(2-methyl-1H-inden-5-yl)naphthalene

1-(2-methyl-1H-inden-5-yl)naphthalene (PubChem CID 54474031) has the molecular formula C20H16 and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-(2-methyl-1H-inden-5-yl)naphthalene.

Molecular Properties

Compound Name1-(2-methyl-1H-inden-5-yl)naphthalene
PubChem CID54474031
Molecular FormulaC20H16
Molecular Weight256.35 g/mol
Exact Mass256.13
IUPAC Name1-(2-methyl-1H-inden-5-yl)naphthalene
SMILESCC1=Cc2cc(-c3cccc4ccccc34)ccc2C1
InChIInChI=1S/C20H16/c1-14-11-16-9-10-17(13-18(16)12-14)20-8-4-6-15-5-2-3-7-19(15)20/h2-10,12-13H,11H2,1H3
InChIKeyNBZJLRFLLUSVNM-UHFFFAOYSA-N
XLogP5.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500256.35
LogP ≤ 55.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-1H-inden-5-yl)naphthalene?
The IUPAC name of 1-(2-methyl-1H-inden-5-yl)naphthalene (CID 54474031) is 1-(2-methyl-1H-inden-5-yl)naphthalene.
What is the SMILES notation for 1-(2-methyl-1H-inden-5-yl)naphthalene?
The canonical SMILES for 1-(2-methyl-1H-inden-5-yl)naphthalene is CC1=Cc2cc(-c3cccc4ccccc34)ccc2C1.
What is the InChIKey of 1-(2-methyl-1H-inden-5-yl)naphthalene?
The InChIKey is NBZJLRFLLUSVNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16/c1-14-11-16-9-10-17(13-18(16)12-14)20-8-4-6-15-5-2-3-7-19(15)20/h2-10,12-13H,11H2,1H3.
What are the key properties of 1-(2-methyl-1H-inden-5-yl)naphthalene?
1-(2-methyl-1H-inden-5-yl)naphthalene has a molecular weight of 256.35 g/mol, XLogP of 5.47, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-1H-inden-5-yl)naphthalene is sourced from PubChem (CID 54474031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).