2-methyl-3-(2-methyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalene

C30H28 — CID 87557442

IUPAC2-methyl-3-(2-methyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalene
SMILESCC1=Cc2ccccc2C1c1cc2ccccc2c(-c2ccc(C)c(C)c2C)c1C
InChIInChI=1S/C30H28/c1-18-14-15-25(21(4)20(18)3)30-22(5)28(17-24-11-7-9-13-27(24)30)29-19(2)16-23-10-6-8-12-26(23)29/h6-17,29H,1-5H3
InChIKeyHBYWGVSPHFLTKR-UHFFFAOYSA-N
MW388.55 g/mol
LogP8.29
Rot. Bonds2

About 2-methyl-3-(2-methyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalene

2-methyl-3-(2-methyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalene (PubChem CID 87557442) has the molecular formula C30H28 and a molecular weight of 388.55 g/mol. Its IUPAC name is 2-methyl-3-(2-methyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalene.

Molecular Properties

Compound Name2-methyl-3-(2-methyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalene
PubChem CID87557442
Molecular FormulaC30H28
Molecular Weight388.55 g/mol
Exact Mass388.22
IUPAC Name2-methyl-3-(2-methyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalene
SMILESCC1=Cc2ccccc2C1c1cc2ccccc2c(-c2ccc(C)c(C)c2C)c1C
InChIInChI=1S/C30H28/c1-18-14-15-25(21(4)20(18)3)30-22(5)28(17-24-11-7-9-13-27(24)30)29-19(2)16-23-10-6-8-12-26(23)29/h6-17,29H,1-5H3
InChIKeyHBYWGVSPHFLTKR-UHFFFAOYSA-N
XLogP8.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.55
LogP ≤ 58.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

[3-(2-phenyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalen-2-yl]methanimine
CID 87494464
1-cyclohexyl-2-methyl-3-(2-methyl-1H-inden-1-yl)naphthalene
CID 87492929
[3-(2-methyl-1H-inden-1-yl)-1-phenylnaphthalen-2-yl]methanimine
CID 87493467
3-(2-methyl-1H-inden-1-yl)naphthalene-2-carbaldehyde
CID 139946435
1-methyl-2-(2,3,4-trimethylphenyl)-1H-indene
CID 21095645
2-(2-methyl-1H-inden-1-yl)naphthalene-1-carbaldehyde
CID 139946468
2-[10-[4-(2-methyl-1H-inden-1-yl)phenyl]anthracen-9-yl]fluoranthene
CID 167712192
[2-(2-methyl-1H-inden-1-yl)naphthalen-1-yl]methyl-(2,4,6-trimethylphenyl)azanide;titanium
CID 87586888
2,2-dimethyl-1-[2-(2-methyl-1H-inden-1-yl)naphthalen-1-yl]propan-1-ol
CID 139951457
1,3-dimethyl-2-[2-(2-methyl-1H-inden-1-yl)phenyl]-1H-indene
CID 177222864
[2-(2-methyl-1H-inden-1-yl)naphthalen-1-yl]methyl-(2,4,6-trimethylphenyl)azanide;titanium(3+);dichloride
CID 87500510
2,3-dimethyl-1-naphthalen-1-ylnaphthalene
CID 54572329

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(2-methyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalene?
The IUPAC name of 2-methyl-3-(2-methyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalene (CID 87557442) is 2-methyl-3-(2-methyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalene.
What is the SMILES notation for 2-methyl-3-(2-methyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalene?
The canonical SMILES for 2-methyl-3-(2-methyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalene is CC1=Cc2ccccc2C1c1cc2ccccc2c(-c2ccc(C)c(C)c2C)c1C.
What is the InChIKey of 2-methyl-3-(2-methyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalene?
The InChIKey is HBYWGVSPHFLTKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H28/c1-18-14-15-25(21(4)20(18)3)30-22(5)28(17-24-11-7-9-13-27(24)30)29-19(2)16-23-10-6-8-12-26(23)29/h6-17,29H,1-5H3.
What are the key properties of 2-methyl-3-(2-methyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalene?
2-methyl-3-(2-methyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalene has a molecular weight of 388.55 g/mol, XLogP of 8.29, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(2-methyl-1H-inden-1-yl)-1-(2,3,4-trimethylphenyl)naphthalene is sourced from PubChem (CID 87557442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).