2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene

C26H30O — CID 71127696

IUPAC2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene
SMILESCc1cc2c(c(-c3c(C)ccc4ccccc34)c1OC(C)(C)C)CCCC2
InChIInChI=1S/C26H30O/c1-17-14-15-19-10-6-8-12-21(19)23(17)24-22-13-9-7-11-20(22)16-18(2)25(24)27-26(3,4)5/h6,8,10,12,14-16H,7,9,11,13H2,1-5H3
InChIKeyWNNLBDTVHZQBDJ-UHFFFAOYSA-N
MW358.53 g/mol
LogP7.18
Rot. Bonds2

About 2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene

2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene (PubChem CID 71127696) has the molecular formula C26H30O and a molecular weight of 358.53 g/mol. Its IUPAC name is 2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene.

Molecular Properties

Compound Name2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene
PubChem CID71127696
Molecular FormulaC26H30O
Molecular Weight358.53 g/mol
Exact Mass358.23
IUPAC Name2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene
SMILESCc1cc2c(c(-c3c(C)ccc4ccccc34)c1OC(C)(C)C)CCCC2
InChIInChI=1S/C26H30O/c1-17-14-15-19-10-6-8-12-21(19)23(17)24-22-13-9-7-11-20(22)16-18(2)25(24)27-26(3,4)5/h6,8,10,12,14-16H,7,9,11,13H2,1-5H3
InChIKeyWNNLBDTVHZQBDJ-UHFFFAOYSA-N
XLogP7.18
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.53
LogP ≤ 57.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene 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 2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene?
The IUPAC name of 2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene (CID 71127696) is 2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene.
What is the SMILES notation for 2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene?
The canonical SMILES for 2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene is Cc1cc2c(c(-c3c(C)ccc4ccccc34)c1OC(C)(C)C)CCCC2.
What is the InChIKey of 2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene?
The InChIKey is WNNLBDTVHZQBDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30O/c1-17-14-15-19-10-6-8-12-21(19)23(17)24-22-13-9-7-11-20(22)16-18(2)25(24)27-26(3,4)5/h6,8,10,12,14-16H,7,9,11,13H2,1-5H3.
What are the key properties of 2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene?
2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene has a molecular weight of 358.53 g/mol, XLogP of 7.18, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[3-methyl-2-[(2-methylpropan-2-yl)oxy]-5,6,7,8-tetrahydronaphthalen-1-yl]naphthalene is sourced from PubChem (CID 71127696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).