8-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalene

C21H24 — CID 91231570

IUPAC8-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalene
SMILESCc1cccc2c1CC(c1ccc3c(c1)CCCC3)CC2
InChIInChI=1S/C21H24/c1-15-5-4-8-17-10-12-20(14-21(15)17)19-11-9-16-6-2-3-7-18(16)13-19/h4-5,8-9,11,13,20H,2-3,6-7,10,12,14H2,1H3
InChIKeyISRKKXHUYQJRQQ-UHFFFAOYSA-N
MW276.42 g/mol
LogP5.15
Rot. Bonds1

About 8-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalene

8-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalene (PubChem CID 91231570) has the molecular formula C21H24 and a molecular weight of 276.42 g/mol. Its IUPAC name is 8-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name8-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalene
PubChem CID91231570
Molecular FormulaC21H24
Molecular Weight276.42 g/mol
Exact Mass276.19
IUPAC Name8-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalene
SMILESCc1cccc2c1CC(c1ccc3c(c1)CCCC3)CC2
InChIInChI=1S/C21H24/c1-15-5-4-8-17-10-12-20(14-21(15)17)19-11-9-16-6-2-3-7-18(16)13-19/h4-5,8-9,11,13,20H,2-3,6-7,10,12,14H2,1H3
InChIKeyISRKKXHUYQJRQQ-UHFFFAOYSA-N
XLogP5.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.42
LogP ≤ 55.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

5-methyl-2-phenyl-1,2,3,4-tetrahydronaphthalene
CID 59215088
N-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobutan-1-amine
CID 156864691
[1-(3-methylphenyl)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclohexyl]methanamine
CID 70294454
1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene
CID 173404050
N,8-dimethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 58777905
ethane;5-ethyl-1,2,3,4-tetrahydronaphthalene;bis(6-methyl-1,2,3,4-tetrahydronaphthalene)
CID 142243189
[3-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclopentyl]methanol
CID 144689190
bicyclo[4.2.0]octa-1,3,5-triene;2,3-dihydro-1H-indene;5,6,7,8,9,10-hexahydrobenzo[8]annulene;6,7,8,9,10,11-hexahydro-5H-benzo[9]annulene;5,6,7,8,9,10,11,12-octahydrobenzo[10]annulene;6,7,8,9-tetrahydro-5H-benzo[7]annulene;1,2,3,4-tetrahydronaphthalene;1,2-xylene
CID 159244193
methyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane
CID 170002803
3-(2,3-dihydro-1H-inden-5-yl)cycloheptan-1-ol
CID 114194593
5-cyclobutyl-4-methyl-2,3-dihydro-1H-indene
CID 156857499
2-(6-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)-6-methylnaphthalene
CID 139848916

Frequently Asked Questions

What is the IUPAC name of 8-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 8-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalene (CID 91231570) is 8-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 8-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 8-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalene is Cc1cccc2c1CC(c1ccc3c(c1)CCCC3)CC2.
What is the InChIKey of 8-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalene?
The InChIKey is ISRKKXHUYQJRQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24/c1-15-5-4-8-17-10-12-20(14-21(15)17)19-11-9-16-6-2-3-7-18(16)13-19/h4-5,8-9,11,13,20H,2-3,6-7,10,12,14H2,1H3.
What are the key properties of 8-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalene?
8-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalene has a molecular weight of 276.42 g/mol, XLogP of 5.15, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 91231570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).