(2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone

C19H22O3 — CID 172752328

IUPAC(2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone
SMILESCOc1cccc(OC)c1C(=O)c1c(C)cc(C)c(C)c1C
InChIInChI=1S/C19H22O3/c1-11-10-12(2)17(14(4)13(11)3)19(20)18-15(21-5)8-7-9-16(18)22-6/h7-10H,1-6H3
InChIKeyKNQROGGBCHWSNC-UHFFFAOYSA-N
MW298.38 g/mol
LogP4.17
Rot. Bonds4

About (2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone

(2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone (PubChem CID 172752328) has the molecular formula C19H22O3 and a molecular weight of 298.38 g/mol. Its IUPAC name is (2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone.

Molecular Properties

Compound Name(2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone
PubChem CID172752328
Molecular FormulaC19H22O3
Molecular Weight298.38 g/mol
Exact Mass298.16
IUPAC Name(2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone
SMILESCOc1cccc(OC)c1C(=O)c1c(C)cc(C)c(C)c1C
InChIInChI=1S/C19H22O3/c1-11-10-12(2)17(14(4)13(11)3)19(20)18-15(21-5)8-7-9-16(18)22-6/h7-10H,1-6H3
InChIKeyKNQROGGBCHWSNC-UHFFFAOYSA-N
XLogP4.17
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.38
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone
CID 112698836
2-(2-methoxyphenyl)-1-(2,3,5,6-tetramethylphenyl)ethanone
CID 43337338
bis(3-methoxy-2-methylphenyl)methanone
CID 139698462
(3-methoxy-2,6-dimethylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone
CID 22671386
[2-[hydroxy-(2-methoxyphenyl)methyl]phenyl]-(2,3,5,6-tetramethylphenyl)methanone
CID 138973203
bis(2,4-dimethoxy-6-methylphenyl)methanone
CID 54389353
(4-fluoro-3,5-dimethylphenyl)-(2-fluoro-6-methoxyphenyl)methanone
CID 65433422
[2-oxo-2-(2,3,4,6-tetramethylphenyl)ethyl] 2,3,4-trimethoxybenzoate
CID 8610653
(2,6-dimethylphenyl)-(2-methoxyphenyl)methanone
CID 24722767
[3-methyl-2-(2,3,4-trimethoxy-6-methylbenzoyl)phenyl] acetate
CID 22671378
(2-chloro-4-fluoro-5-methylphenyl)-(2,6-dimethoxyphenyl)methanone
CID 81047587
4-(2,6-dimethoxybenzoyl)-1-methylpyrrole-2-carboxylic acid
CID 43162043

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone?
The IUPAC name of (2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone (CID 172752328) is (2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone.
What is the SMILES notation for (2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone?
The canonical SMILES for (2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone is COc1cccc(OC)c1C(=O)c1c(C)cc(C)c(C)c1C.
What is the InChIKey of (2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone?
The InChIKey is KNQROGGBCHWSNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O3/c1-11-10-12(2)17(14(4)13(11)3)19(20)18-15(21-5)8-7-9-16(18)22-6/h7-10H,1-6H3.
What are the key properties of (2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone?
(2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone has a molecular weight of 298.38 g/mol, XLogP of 4.17, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone is sourced from PubChem (CID 172752328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).