1-methoxy-4-[3-methyl-2-(4-methylphenyl)cyclobutyl]benzene

C19H22O — CID 132838745

IUPAC1-methoxy-4-[3-methyl-2-(4-methylphenyl)cyclobutyl]benzene
SMILESCOc1ccc(C2CC(C)C2c2ccc(C)cc2)cc1
InChIInChI=1S/C19H22O/c1-13-4-6-16(7-5-13)19-14(2)12-18(19)15-8-10-17(20-3)11-9-15/h4-11,14,18-19H,12H2,1-3H3
InChIKeyGBDYCPKPSCTAMG-UHFFFAOYSA-N
MW266.38 g/mol
LogP4.91
Rot. Bonds3

About 1-methoxy-4-[3-methyl-2-(4-methylphenyl)cyclobutyl]benzene

1-methoxy-4-[3-methyl-2-(4-methylphenyl)cyclobutyl]benzene (PubChem CID 132838745) has the molecular formula C19H22O and a molecular weight of 266.38 g/mol. Its IUPAC name is 1-methoxy-4-[3-methyl-2-(4-methylphenyl)cyclobutyl]benzene.

Molecular Properties

Compound Name1-methoxy-4-[3-methyl-2-(4-methylphenyl)cyclobutyl]benzene
PubChem CID132838745
Molecular FormulaC19H22O
Molecular Weight266.38 g/mol
Exact Mass266.17
IUPAC Name1-methoxy-4-[3-methyl-2-(4-methylphenyl)cyclobutyl]benzene
SMILESCOc1ccc(C2CC(C)C2c2ccc(C)cc2)cc1
InChIInChI=1S/C19H22O/c1-13-4-6-16(7-5-13)19-14(2)12-18(19)15-8-10-17(20-3)11-9-15/h4-11,14,18-19H,12H2,1-3H3
InChIKeyGBDYCPKPSCTAMG-UHFFFAOYSA-N
XLogP4.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-chlorocyclopropyl)-4-methoxybenzene
CID 53421606
1-(113C)methoxy-4-methylbenzene
CID 166176950
(4S)-3-(4-methoxyphenyl)-4-methylpyrrolidine
CID 58606780
(2S,2aS,8aR)-2-(4-methoxyphenyl)-1,2,2a,8a-tetrahydrocyclobuta[b]naphthalene-3,8-dione
CID 102247086
1,4-dimethoxybenzene;ethane;methane;1,4-xylene
CID 161140185
1-methoxy-4-[2-(4-methoxyphenyl)cyclohexyl]benzene
CID 101244821
1-methoxy-4-methylbenzene;propane
CID 142064987
methane;1-methoxy-4-(4-methylphenyl)benzene
CID 159881054
(1S,2R,6S,7R,8S,10R)-9-(4-methoxyphenyl)-4-(4-methylphenyl)-4-azatetracyclo[5.3.1.02,6.08,10]undecane-3,5-dione
CID 102129666
(E)-1-[(1S,2S)-2-(4-chlorophenyl)cyclopropyl]-1-(4-methoxyphenyl)-N-[(4-methylphenyl)methoxy]methanimine
CID 40544488
(E)-1-[(1R,2R)-2-(4-chlorophenyl)cyclopropyl]-1-(4-methoxyphenyl)-N-[(4-methylphenyl)methoxy]methanimine
CID 40544487
1-[(1S,2R,3R,4S)-2,3-dimethyl-4-phenylcyclobutyl]-4-methoxybenzene
CID 134955785

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-[3-methyl-2-(4-methylphenyl)cyclobutyl]benzene?
The IUPAC name of 1-methoxy-4-[3-methyl-2-(4-methylphenyl)cyclobutyl]benzene (CID 132838745) is 1-methoxy-4-[3-methyl-2-(4-methylphenyl)cyclobutyl]benzene.
What is the SMILES notation for 1-methoxy-4-[3-methyl-2-(4-methylphenyl)cyclobutyl]benzene?
The canonical SMILES for 1-methoxy-4-[3-methyl-2-(4-methylphenyl)cyclobutyl]benzene is COc1ccc(C2CC(C)C2c2ccc(C)cc2)cc1.
What is the InChIKey of 1-methoxy-4-[3-methyl-2-(4-methylphenyl)cyclobutyl]benzene?
The InChIKey is GBDYCPKPSCTAMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O/c1-13-4-6-16(7-5-13)19-14(2)12-18(19)15-8-10-17(20-3)11-9-15/h4-11,14,18-19H,12H2,1-3H3.
What are the key properties of 1-methoxy-4-[3-methyl-2-(4-methylphenyl)cyclobutyl]benzene?
1-methoxy-4-[3-methyl-2-(4-methylphenyl)cyclobutyl]benzene has a molecular weight of 266.38 g/mol, XLogP of 4.91, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4-[3-methyl-2-(4-methylphenyl)cyclobutyl]benzene is sourced from PubChem (CID 132838745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).