ethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene

C28H36 — CID 166479896

IUPACethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene
SMILESCC.CC.Cc1ccc(-c2cccc(C3CC(C)Cc4ccccc43)c2)cc1
InChIInChI=1S/C24H24.2C2H6/c1-17-10-12-19(13-11-17)20-7-5-8-22(16-20)24-15-18(2)14-21-6-3-4-9-23(21)24;2*1-2/h3-13,16,18,24H,14-15H2,1-2H3;2*1-2H3
InChIKeyLHUUGELGWLFPOW-UHFFFAOYSA-N
MW372.60 g/mol
LogP8.43
Rot. Bonds2

About ethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene

ethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene (PubChem CID 166479896) has the molecular formula C28H36 and a molecular weight of 372.60 g/mol. Its IUPAC name is ethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Nameethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene
PubChem CID166479896
Molecular FormulaC28H36
Molecular Weight372.60 g/mol
Exact Mass372.28
IUPAC Nameethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene
SMILESCC.CC.Cc1ccc(-c2cccc(C3CC(C)Cc4ccccc43)c2)cc1
InChIInChI=1S/C24H24.2C2H6/c1-17-10-12-19(13-11-17)20-7-5-8-22(16-20)24-15-18(2)14-21-6-3-4-9-23(21)24;2*1-2/h3-13,16,18,24H,14-15H2,1-2H3;2*1-2H3
InChIKeyLHUUGELGWLFPOW-UHFFFAOYSA-N
XLogP8.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.60
LogP ≤ 58.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze ethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-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

3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene
CID 166479897
(1R,3R)-1-[3-(4-chlorophenyl)phenyl]-3-methyl-1,2,3,4-tetrahydronaphthalene
CID 166479964
2-[3-[(3S)-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]phenyl]furan
CID 166479963
(2S,4R)-N,N-dimethyl-4-(3-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
CID 118729275
(2S,4S)-N,N-dimethyl-4-(3-pyridin-4-ylphenyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 166638669
4-(3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)phenol
CID 15629688
(1R,3S)-3-ethyl-1-[3-(3-fluorophenyl)phenyl]-1,2,3,4-tetrahydronaphthalene
CID 166479948
(2R,4R)-4-[3-(3-fluorophenyl)phenyl]-N,N-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 166638679
ethane;(1S,3R)-1-[3-[(3E,5Z)-hepta-1,3,5-trien-4-yl]phenyl]-3-methyl-1,2,3,4-tetrahydronaphthalene
CID 166479860
N,N-dimethyl-4-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 42601568
8-methyl-4-(4-methylphenyl)-9-phenyltricyclo[9.4.0.02,7]pentadeca-1(15),2(7),3,5,11,13-hexaene
CID 143904645
ethane;4-(3-methylphenyl)-3,4-dihydro-1H-naphthalen-2-one
CID 166479863

Frequently Asked Questions

What is the IUPAC name of ethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of ethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene (CID 166479896) is ethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for ethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for ethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene is CC.CC.Cc1ccc(-c2cccc(C3CC(C)Cc4ccccc43)c2)cc1.
What is the InChIKey of ethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene?
The InChIKey is LHUUGELGWLFPOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24.2C2H6/c1-17-10-12-19(13-11-17)20-7-5-8-22(16-20)24-15-18(2)14-21-6-3-4-9-23(21)24;2*1-2/h3-13,16,18,24H,14-15H2,1-2H3;2*1-2H3.
What are the key properties of ethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene?
ethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene has a molecular weight of 372.60 g/mol, XLogP of 8.43, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-methyl-1-[3-(4-methylphenyl)phenyl]-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 166479896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).