1-(1H-inden-4-yl)-2-methylnaphthalene

C20H16 — CID 57037744

IUPAC1-(1H-inden-4-yl)-2-methylnaphthalene
SMILESCc1ccc2ccccc2c1-c1cccc2c1C=CC2
InChIInChI=1S/C20H16/c1-14-12-13-16-6-2-3-9-18(16)20(14)19-11-5-8-15-7-4-10-17(15)19/h2-6,8-13H,7H2,1H3
InChIKeyHBTKJIIIKYNZGS-UHFFFAOYSA-N
MW256.35 g/mol
LogP5.38
Rot. Bonds1

About 1-(1H-inden-4-yl)-2-methylnaphthalene

1-(1H-inden-4-yl)-2-methylnaphthalene (PubChem CID 57037744) has the molecular formula C20H16 and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-(1H-inden-4-yl)-2-methylnaphthalene.

Molecular Properties

Compound Name1-(1H-inden-4-yl)-2-methylnaphthalene
PubChem CID57037744
Molecular FormulaC20H16
Molecular Weight256.35 g/mol
Exact Mass256.13
IUPAC Name1-(1H-inden-4-yl)-2-methylnaphthalene
SMILESCc1ccc2ccccc2c1-c1cccc2c1C=CC2
InChIInChI=1S/C20H16/c1-14-12-13-16-6-2-3-9-18(16)20(14)19-11-5-8-15-7-4-10-17(15)19/h2-6,8-13H,7H2,1H3
InChIKeyHBTKJIIIKYNZGS-UHFFFAOYSA-N
XLogP5.38
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 ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-inden-4-yl)-2-methylnaphthalene?
The IUPAC name of 1-(1H-inden-4-yl)-2-methylnaphthalene (CID 57037744) is 1-(1H-inden-4-yl)-2-methylnaphthalene.
What is the SMILES notation for 1-(1H-inden-4-yl)-2-methylnaphthalene?
The canonical SMILES for 1-(1H-inden-4-yl)-2-methylnaphthalene is Cc1ccc2ccccc2c1-c1cccc2c1C=CC2.
What is the InChIKey of 1-(1H-inden-4-yl)-2-methylnaphthalene?
The InChIKey is HBTKJIIIKYNZGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16/c1-14-12-13-16-6-2-3-9-18(16)20(14)19-11-5-8-15-7-4-10-17(15)19/h2-6,8-13H,7H2,1H3.
What are the key properties of 1-(1H-inden-4-yl)-2-methylnaphthalene?
1-(1H-inden-4-yl)-2-methylnaphthalene has a molecular weight of 256.35 g/mol, XLogP of 5.38, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-inden-4-yl)-2-methylnaphthalene is sourced from PubChem (CID 57037744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).