6-[1-(1,2-dimethyl-3H-inden-5-yl)ethyl]-2,3-dimethyl-1H-indene

C24H26 — CID 173293651

IUPAC6-[1-(1,2-dimethyl-3H-inden-5-yl)ethyl]-2,3-dimethyl-1H-indene
SMILESCC1=C(C)c2ccc(C(C)c3ccc4c(c3)CC(C)=C4C)cc2C1
InChIInChI=1S/C24H26/c1-14-10-21-12-19(6-8-23(21)16(14)3)18(5)20-7-9-24-17(4)15(2)11-22(24)13-20/h6-9,12-13,18H,10-11H2,1-5H3
InChIKeyGWBUUSTYMDGAHG-UHFFFAOYSA-N
MW314.47 g/mol
LogP6.54
Rot. Bonds2

About 6-[1-(1,2-dimethyl-3H-inden-5-yl)ethyl]-2,3-dimethyl-1H-indene

6-[1-(1,2-dimethyl-3H-inden-5-yl)ethyl]-2,3-dimethyl-1H-indene (PubChem CID 173293651) has the molecular formula C24H26 and a molecular weight of 314.47 g/mol. Its IUPAC name is 6-[1-(1,2-dimethyl-3H-inden-5-yl)ethyl]-2,3-dimethyl-1H-indene.

Molecular Properties

Compound Name6-[1-(1,2-dimethyl-3H-inden-5-yl)ethyl]-2,3-dimethyl-1H-indene
PubChem CID173293651
Molecular FormulaC24H26
Molecular Weight314.47 g/mol
Exact Mass314.20
IUPAC Name6-[1-(1,2-dimethyl-3H-inden-5-yl)ethyl]-2,3-dimethyl-1H-indene
SMILESCC1=C(C)c2ccc(C(C)c3ccc4c(c3)CC(C)=C4C)cc2C1
InChIInChI=1S/C24H26/c1-14-10-21-12-19(6-8-23(21)16(14)3)18(5)20-7-9-24-17(4)15(2)11-22(24)13-20/h6-9,12-13,18H,10-11H2,1-5H3
InChIKeyGWBUUSTYMDGAHG-UHFFFAOYSA-N
XLogP6.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.47
LogP ≤ 56.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,3-dimethyl-6-phenyl-1H-indene
CID 173147949
2,3-dimethyl-1H-indene;ethane
CID 54108652
lithium;2,3-dimethyl-1H-indene;hydride
CID 174422478
2-fluoro-4-[1-(3-fluoro-4-methylphenyl)ethyl]-1-methylbenzene
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CID 177091322
3-methyl-6-propan-2-yl-1H-isoindole
CID 170283669
2-(1-bromopropan-2-yl)-9H-fluorene
CID 66469849
N-[1-(9H-fluoren-2-yl)ethyl]propan-2-amine
CID 43095190
2,3-dimethyl-6-naphthalen-2-yl-1H-cyclopenta[b]naphthalene
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2-methyl-7-propan-2-yl-4H-indeno[2,1-b]thiophene
CID 70851633
1-(9H-fluoren-2-yl)-2-propan-2-ylsulfanylethanamine
CID 64634231

Frequently Asked Questions

What is the IUPAC name of 6-[1-(1,2-dimethyl-3H-inden-5-yl)ethyl]-2,3-dimethyl-1H-indene?
The IUPAC name of 6-[1-(1,2-dimethyl-3H-inden-5-yl)ethyl]-2,3-dimethyl-1H-indene (CID 173293651) is 6-[1-(1,2-dimethyl-3H-inden-5-yl)ethyl]-2,3-dimethyl-1H-indene.
What is the SMILES notation for 6-[1-(1,2-dimethyl-3H-inden-5-yl)ethyl]-2,3-dimethyl-1H-indene?
The canonical SMILES for 6-[1-(1,2-dimethyl-3H-inden-5-yl)ethyl]-2,3-dimethyl-1H-indene is CC1=C(C)c2ccc(C(C)c3ccc4c(c3)CC(C)=C4C)cc2C1.
What is the InChIKey of 6-[1-(1,2-dimethyl-3H-inden-5-yl)ethyl]-2,3-dimethyl-1H-indene?
The InChIKey is GWBUUSTYMDGAHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26/c1-14-10-21-12-19(6-8-23(21)16(14)3)18(5)20-7-9-24-17(4)15(2)11-22(24)13-20/h6-9,12-13,18H,10-11H2,1-5H3.
What are the key properties of 6-[1-(1,2-dimethyl-3H-inden-5-yl)ethyl]-2,3-dimethyl-1H-indene?
6-[1-(1,2-dimethyl-3H-inden-5-yl)ethyl]-2,3-dimethyl-1H-indene has a molecular weight of 314.47 g/mol, XLogP of 6.54, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(1,2-dimethyl-3H-inden-5-yl)ethyl]-2,3-dimethyl-1H-indene is sourced from PubChem (CID 173293651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).