(2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone

C18H20O3 — CID 112698836

IUPAC(2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone
SMILESCOc1cccc(OC)c1C(=O)c1cc(C)c(C)cc1C
InChIInChI=1S/C18H20O3/c1-11-9-13(3)14(10-12(11)2)18(19)17-15(20-4)7-6-8-16(17)21-5/h6-10H,1-5H3
InChIKeyIQUGHKFQEGOAGS-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.86
Rot. Bonds4

About (2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone

(2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone (PubChem CID 112698836) has the molecular formula C18H20O3 and a molecular weight of 284.36 g/mol. Its IUPAC name is (2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone.

Molecular Properties

Compound Name(2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone
PubChem CID112698836
Molecular FormulaC18H20O3
Molecular Weight284.36 g/mol
Exact Mass284.14
IUPAC Name(2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone
SMILESCOc1cccc(OC)c1C(=O)c1cc(C)c(C)cc1C
InChIInChI=1S/C18H20O3/c1-11-9-13(3)14(10-12(11)2)18(19)17-15(20-4)7-6-8-16(17)21-5/h6-10H,1-5H3
InChIKeyIQUGHKFQEGOAGS-UHFFFAOYSA-N
XLogP3.86
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2,6-dimethoxyphenyl)-(2,3,4,6-tetramethylphenyl)methanone
CID 172752328
(2-chloro-4-fluoro-5-methylphenyl)-(2,6-dimethoxyphenyl)methanone
CID 81047587
(2,6-dimethylphenyl)-(2-methoxyphenyl)methanone
CID 24722767
(2,6-dimethoxyphenyl)-(2,4,5-trifluorophenyl)methanone
CID 103301259
(5-bromo-2-methoxyphenyl)-(2,6-dimethoxyphenyl)methanone
CID 43339938
[2-bis(2,4,6-trimethylbenzoyl)phosphorylphenyl]-(2,6-dimethoxyphenyl)methanone
CID 158862858
[2-(2,6-dimethoxybenzoyl)phenyl]-oxo-(2,4,6-trimethylbenzoyl)phosphanium
CID 173244334
methyl 2-(2,6-dimethoxybenzoyl)benzoate
CID 71397959
(4-methoxy-2,5-dimethylphenyl)-(6-methyl-2-pyridinyl)methanone
CID 113370085
[2-(2,6-dimethoxy-3,5-dimethylbenzoyl)phenyl]-(2,4,6-trimethoxyphenyl)methanone
CID 141015987
(2,3-dichlorophenyl)-(2,6-dimethoxyphenyl)methanone
CID 114970477
(4-chloro-2-fluorophenyl)-(2,6-dimethoxyphenyl)methanone
CID 116809979

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone?
The IUPAC name of (2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone (CID 112698836) is (2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone.
What is the SMILES notation for (2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone?
The canonical SMILES for (2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone is COc1cccc(OC)c1C(=O)c1cc(C)c(C)cc1C.
What is the InChIKey of (2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone?
The InChIKey is IQUGHKFQEGOAGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O3/c1-11-9-13(3)14(10-12(11)2)18(19)17-15(20-4)7-6-8-16(17)21-5/h6-10H,1-5H3.
What are the key properties of (2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone?
(2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone has a molecular weight of 284.36 g/mol, XLogP of 3.86, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethoxyphenyl)-(2,4,5-trimethylphenyl)methanone is sourced from PubChem (CID 112698836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).