5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol

C23H28O — CID 69479943

IUPAC5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol
SMILESC=C(c1ccc(C)cc1)c1cc2c(cc1O)C(C)(C)CCC2(C)C
InChIInChI=1S/C23H28O/c1-15-7-9-17(10-8-15)16(2)18-13-19-20(14-21(18)24)23(5,6)12-11-22(19,3)4/h7-10,13-14,24H,2,11-12H2,1,3-6H3
InChIKeyLCCYPQMHDKOMIC-UHFFFAOYSA-N
MW320.48 g/mol
LogP6.11
Rot. Bonds2

About 5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol

5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol (PubChem CID 69479943) has the molecular formula C23H28O and a molecular weight of 320.48 g/mol. Its IUPAC name is 5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol.

Molecular Properties

Compound Name5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol
PubChem CID69479943
Molecular FormulaC23H28O
Molecular Weight320.48 g/mol
Exact Mass320.21
IUPAC Name5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol
SMILESC=C(c1ccc(C)cc1)c1cc2c(cc1O)C(C)(C)CCC2(C)C
InChIInChI=1S/C23H28O/c1-15-7-9-17(10-8-15)16(2)18-13-19-20(14-21(18)24)23(5,6)12-11-22(19,3)4/h7-10,13-14,24H,2,11-12H2,1,3-6H3
InChIKeyLCCYPQMHDKOMIC-UHFFFAOYSA-N
XLogP6.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.48
LogP ≤ 56.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol?
The IUPAC name of 5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol (CID 69479943) is 5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol.
What is the SMILES notation for 5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol?
The canonical SMILES for 5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol is C=C(c1ccc(C)cc1)c1cc2c(cc1O)C(C)(C)CCC2(C)C.
What is the InChIKey of 5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol?
The InChIKey is LCCYPQMHDKOMIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28O/c1-15-7-9-17(10-8-15)16(2)18-13-19-20(14-21(18)24)23(5,6)12-11-22(19,3)4/h7-10,13-14,24H,2,11-12H2,1,3-6H3.
What are the key properties of 5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol?
5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol has a molecular weight of 320.48 g/mol, XLogP of 6.11, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5,8,8-tetramethyl-3-[1-(4-methylphenyl)ethenyl]-6,7-dihydronaphthalen-2-ol is sourced from PubChem (CID 69479943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).