1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene

C20H26 — CID 59165315

IUPAC1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene
SMILESCC1=C2CCCCC2=C(C2=C3CCCCC3=C(C)C2)C1
InChIInChI=1S/C20H26/c1-13-11-19(17-9-5-3-7-15(13)17)20-12-14(2)16-8-4-6-10-18(16)20/h3-12H2,1-2H3
InChIKeyQHAYHMHKZRSAHG-UHFFFAOYSA-N
MW266.43 g/mol
LogP6.17
Rot. Bonds1

About 1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene

1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene (PubChem CID 59165315) has the molecular formula C20H26 and a molecular weight of 266.43 g/mol. Its IUPAC name is 1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene.

Molecular Properties

Compound Name1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene
PubChem CID59165315
Molecular FormulaC20H26
Molecular Weight266.43 g/mol
Exact Mass266.20
IUPAC Name1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene
SMILESCC1=C2CCCCC2=C(C2=C3CCCCC3=C(C)C2)C1
InChIInChI=1S/C20H26/c1-13-11-19(17-9-5-3-7-15(13)17)20-12-14(2)16-8-4-6-10-18(16)20/h3-12H2,1-2H3
InChIKeyQHAYHMHKZRSAHG-UHFFFAOYSA-N
XLogP6.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.43
LogP ≤ 56.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene with MolForge

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Related Compounds

pentacyclo[14.12.0.02,15.08,23.09,22]octacosa-1(16),2(15),8,22-tetraene
CID 15164275
1-methyl-3-(3-methyl-4,7-dihydro-2H-inden-1-yl)-4,7-dihydro-2H-indene
CID 59165309
tricyclo[4.3.0.02,7]nona-1,6-diene
CID 149382388
4,6,6,7-tetramethyl-1,2,3,5-tetrahydroindene
CID 15497622
manganese;2,3,4,5,6,7,8,9-octahydro-1H-fluorene
CID 174386744
2-methyl-4,5,6,7-tetrahydroinden-1-one
CID 142636804
CID 123913413
CID 123913413
5,6,7,8-tetrahydrophthalazine-1,4-dione
CID 78176786
1,3-dipropyl-4,5,6,7-tetrahydro-2H-indene
CID 102100274
2-iodo-3-methylcyclohept-2-en-1-one
CID 11770818
1,2-dimethylcyclopentene;molecular fluorine
CID 157100565
cycloheptane-1,3-dione
CID 4072367

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene?
The IUPAC name of 1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene (CID 59165315) is 1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene.
What is the SMILES notation for 1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene?
The canonical SMILES for 1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene is CC1=C2CCCCC2=C(C2=C3CCCCC3=C(C)C2)C1.
What is the InChIKey of 1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene?
The InChIKey is QHAYHMHKZRSAHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26/c1-13-11-19(17-9-5-3-7-15(13)17)20-12-14(2)16-8-4-6-10-18(16)20/h3-12H2,1-2H3.
What are the key properties of 1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene?
1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene has a molecular weight of 266.43 g/mol, XLogP of 6.17, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene is sourced from PubChem (CID 59165315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).