6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene

C28H28 — CID 123515554

IUPAC6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene
SMILESCc1ccc2c(c1)C(Cc1cccc(Cc3ccc4c(c3)CCCC4)c1)=CC2
InChIInChI=1S/C28H28/c1-20-9-11-25-13-14-27(28(25)15-20)19-22-6-4-5-21(16-22)17-23-10-12-24-7-2-3-8-26(24)18-23/h4-6,9-12,14-16,18H,2-3,7-8,13,17,19H2,1H3
InChIKeyRGLFCBFUXSDGRZ-UHFFFAOYSA-N
MW364.53 g/mol
LogP6.65
Rot. Bonds4

About 6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene

6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene (PubChem CID 123515554) has the molecular formula C28H28 and a molecular weight of 364.53 g/mol. Its IUPAC name is 6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene
PubChem CID123515554
Molecular FormulaC28H28
Molecular Weight364.53 g/mol
Exact Mass364.22
IUPAC Name6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene
SMILESCc1ccc2c(c1)C(Cc1cccc(Cc3ccc4c(c3)CCCC4)c1)=CC2
InChIInChI=1S/C28H28/c1-20-9-11-25-13-14-27(28(25)15-20)19-22-6-4-5-21(16-22)17-23-10-12-24-7-2-3-8-26(24)18-23/h4-6,9-12,14-16,18H,2-3,7-8,13,17,19H2,1H3
InChIKeyRGLFCBFUXSDGRZ-UHFFFAOYSA-N
XLogP6.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.53
LogP ≤ 56.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[3-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]phenyl]ethanone
CID 71233327
5-benzyl-2,3-dihydro-1H-indene
CID 142307005
3-[[3-[(3,4-diethylphenyl)methyl]phenyl]methyl]-7-methyl-1H-indene
CID 123849825
3-[8-(3-methylphenyl)octyl]bicyclo[4.2.0]octa-1(6),2,4-triene
CID 58151344
1,2-dichlorobenzene;6-methyl-1,2,3,4-tetrahydronaphthalene
CID 143596446
(3S)-3-amino-4-(6-methyl-3H-inden-1-yl)butan-2-one
CID 167541271
3-amino-4-(6-methyl-3H-inden-1-yl)butan-2-one
CID 167541272
ethane;5-ethyl-1,2,3,4-tetrahydronaphthalene;bis(6-methyl-1,2,3,4-tetrahydronaphthalene)
CID 142243189
2-(2,3-dihydro-1H-inden-5-yl)-1-(2,4-dimethylphenyl)ethanamine
CID 115864870
6-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]-1,2,3,4-tetrahydronaphthalene
CID 19914431
6-(3-methylphenyl)sulfanyl-1,2,3,4-tetrahydronaphthalene
CID 144987176
N-[(3-methylphenyl)methyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 39984880

Frequently Asked Questions

What is the IUPAC name of 6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene (CID 123515554) is 6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene is Cc1ccc2c(c1)C(Cc1cccc(Cc3ccc4c(c3)CCCC4)c1)=CC2.
What is the InChIKey of 6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene?
The InChIKey is RGLFCBFUXSDGRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28/c1-20-9-11-25-13-14-27(28(25)15-20)19-22-6-4-5-21(16-22)17-23-10-12-24-7-2-3-8-26(24)18-23/h4-6,9-12,14-16,18H,2-3,7-8,13,17,19H2,1H3.
What are the key properties of 6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene?
6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene has a molecular weight of 364.53 g/mol, XLogP of 6.65, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[3-[(6-methyl-3H-inden-1-yl)methyl]phenyl]methyl]-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 123515554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).