[2-methyl-1-(2-methyl-2-phenylpropoxy)propan-2-yl]benzene

C20H26O — CID 22274768

IUPAC[2-methyl-1-(2-methyl-2-phenylpropoxy)propan-2-yl]benzene
SMILESCC(C)(COCC(C)(C)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H26O/c1-19(2,17-11-7-5-8-12-17)15-21-16-20(3,4)18-13-9-6-10-14-18/h5-14H,15-16H2,1-4H3
InChIKeyUCRHPKDBKHSCBU-UHFFFAOYSA-N
MW282.43 g/mol
LogP4.96
Rot. Bonds6

About [2-methyl-1-(2-methyl-2-phenylpropoxy)propan-2-yl]benzene

[2-methyl-1-(2-methyl-2-phenylpropoxy)propan-2-yl]benzene (PubChem CID 22274768) has the molecular formula C20H26O and a molecular weight of 282.43 g/mol. Its IUPAC name is [2-methyl-1-(2-methyl-2-phenylpropoxy)propan-2-yl]benzene.

Molecular Properties

Compound Name[2-methyl-1-(2-methyl-2-phenylpropoxy)propan-2-yl]benzene
PubChem CID22274768
Molecular FormulaC20H26O
Molecular Weight282.43 g/mol
Exact Mass282.20
IUPAC Name[2-methyl-1-(2-methyl-2-phenylpropoxy)propan-2-yl]benzene
SMILESCC(C)(COCC(C)(C)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H26O/c1-19(2,17-11-7-5-8-12-17)15-21-16-20(3,4)18-13-9-6-10-14-18/h5-14H,15-16H2,1-4H3
InChIKeyUCRHPKDBKHSCBU-UHFFFAOYSA-N
XLogP4.96
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [2-methyl-1-(2-methyl-2-phenylpropoxy)propan-2-yl]benzene?
The IUPAC name of [2-methyl-1-(2-methyl-2-phenylpropoxy)propan-2-yl]benzene (CID 22274768) is [2-methyl-1-(2-methyl-2-phenylpropoxy)propan-2-yl]benzene.
What is the SMILES notation for [2-methyl-1-(2-methyl-2-phenylpropoxy)propan-2-yl]benzene?
The canonical SMILES for [2-methyl-1-(2-methyl-2-phenylpropoxy)propan-2-yl]benzene is CC(C)(COCC(C)(C)c1ccccc1)c1ccccc1.
What is the InChIKey of [2-methyl-1-(2-methyl-2-phenylpropoxy)propan-2-yl]benzene?
The InChIKey is UCRHPKDBKHSCBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26O/c1-19(2,17-11-7-5-8-12-17)15-21-16-20(3,4)18-13-9-6-10-14-18/h5-14H,15-16H2,1-4H3.
What are the key properties of [2-methyl-1-(2-methyl-2-phenylpropoxy)propan-2-yl]benzene?
[2-methyl-1-(2-methyl-2-phenylpropoxy)propan-2-yl]benzene has a molecular weight of 282.43 g/mol, XLogP of 4.96, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-1-(2-methyl-2-phenylpropoxy)propan-2-yl]benzene is sourced from PubChem (CID 22274768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).