(4-methoxy-3,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanone

C19H22O2 — CID 83043829

IUPAC(4-methoxy-3,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanone
SMILESCOc1c(C)cc(C(=O)c2c(C)cc(C)cc2C)cc1C
InChIInChI=1S/C19H22O2/c1-11-7-12(2)17(13(3)8-11)18(20)16-9-14(4)19(21-6)15(5)10-16/h7-10H,1-6H3
InChIKeyIIWBMYFMEWHNEW-UHFFFAOYSA-N
MW282.38 g/mol
LogP4.47
Rot. Bonds3

About (4-methoxy-3,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanone

(4-methoxy-3,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanone (PubChem CID 83043829) has the molecular formula C19H22O2 and a molecular weight of 282.38 g/mol. Its IUPAC name is (4-methoxy-3,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanone.

Molecular Properties

Compound Name(4-methoxy-3,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanone
PubChem CID83043829
Molecular FormulaC19H22O2
Molecular Weight282.38 g/mol
Exact Mass282.16
IUPAC Name(4-methoxy-3,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanone
SMILESCOc1c(C)cc(C(=O)c2c(C)cc(C)cc2C)cc1C
InChIInChI=1S/C19H22O2/c1-11-7-12(2)17(13(3)8-11)18(20)16-9-14(4)19(21-6)15(5)10-16/h7-10H,1-6H3
InChIKeyIIWBMYFMEWHNEW-UHFFFAOYSA-N
XLogP4.47
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;2-methoxy-1,3,5-trimethylbenzene
CID 142174927
(2,6-difluoro-3-methylphenyl)-(4-methoxy-3,5-dimethylphenyl)methanone
CID 83044009
4-methoxy-3,5-dimethylbenzenecarbothioic S-acid
CID 116918890
(4-bromophenyl)-(4-methoxy-3,5-dimethylphenyl)methanone
CID 2756951
2-(4-methoxy-3,5-dimethylphenyl)-2-oxoacetamide
CID 116924503
(3-amino-4-methylphenyl)-(4-methoxy-3,5-dimethylphenyl)methanone
CID 83068741
(4-ethylphenyl)-(4-methoxy-3,5-dimethylphenyl)methanone
CID 83057344
2-(2-methoxy-3,5-dimethylphenyl)acetamide
CID 82491159
(2,6-dimethoxy-3-phosphorosophenyl)-(2,4,6-trimethylphenyl)methanone
CID 174779309
(3-bromophenyl)-(4-methoxy-3,5-dimethylphenyl)methanone
CID 2756950
(3-amino-5-bromophenyl)-(4-methoxy-3,5-dimethylphenyl)methanone
CID 83068594
2-amino-1-(4-methoxy-3,5-dimethylphenyl)ethanone
CID 82401990

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-3,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanone?
The IUPAC name of (4-methoxy-3,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanone (CID 83043829) is (4-methoxy-3,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanone.
What is the SMILES notation for (4-methoxy-3,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanone?
The canonical SMILES for (4-methoxy-3,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanone is COc1c(C)cc(C(=O)c2c(C)cc(C)cc2C)cc1C.
What is the InChIKey of (4-methoxy-3,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanone?
The InChIKey is IIWBMYFMEWHNEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O2/c1-11-7-12(2)17(13(3)8-11)18(20)16-9-14(4)19(21-6)15(5)10-16/h7-10H,1-6H3.
What are the key properties of (4-methoxy-3,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanone?
(4-methoxy-3,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanone has a molecular weight of 282.38 g/mol, XLogP of 4.47, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-3,5-dimethylphenyl)-(2,4,6-trimethylphenyl)methanone is sourced from PubChem (CID 83043829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).