(2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone

C18H20O3 — CID 106790144

IUPAC(2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone
SMILESCCCOc1ccccc1C(=O)c1ccc(C)cc1OC
InChIInChI=1S/C18H20O3/c1-4-11-21-16-8-6-5-7-14(16)18(19)15-10-9-13(2)12-17(15)20-3/h5-10,12H,4,11H2,1-3H3
InChIKeyQLGVSSPHGBOOQV-UHFFFAOYSA-N
MW284.36 g/mol
LogP4.02
Rot. Bonds6

About (2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone

(2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone (PubChem CID 106790144) has the molecular formula C18H20O3 and a molecular weight of 284.36 g/mol. Its IUPAC name is (2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone.

Molecular Properties

Compound Name(2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone
PubChem CID106790144
Molecular FormulaC18H20O3
Molecular Weight284.36 g/mol
Exact Mass284.14
IUPAC Name(2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone
SMILESCCCOc1ccccc1C(=O)c1ccc(C)cc1OC
InChIInChI=1S/C18H20O3/c1-4-11-21-16-8-6-5-7-14(16)18(19)15-10-9-13(2)12-17(15)20-3/h5-10,12H,4,11H2,1-3H3
InChIKeyQLGVSSPHGBOOQV-UHFFFAOYSA-N
XLogP4.02
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone
CID 115800817
(4-fluoro-2-methylphenyl)-(2-propoxyphenyl)methanone
CID 104659409
(3,6-dimethylpyridazin-4-yl)-(2-propoxyphenyl)methanone
CID 105128622
1-[2-[4-(2-methoxy-4-methylphenoxy)butoxy]phenyl]ethanone
CID 2899242
(2,6-dimethyl-3-pyridinyl)-(2-propoxyphenyl)methanone
CID 105128629
phenyl-(2-propoxyphenyl)methanone
CID 15556308
(3-bromo-5-methylphenyl)-(2-propoxyphenyl)methanone
CID 115800762
(6-methoxypyridazin-3-yl)-(2-propoxyphenyl)methanone
CID 103373209
N-(2,5-dimethylphenyl)-2-propoxybenzamide
CID 4947833
5-methyl-2-(2-propoxyphenoxy)benzoic acid
CID 62514617
2-(2-methoxy-4-methylbenzoyl)-6-methylbenzoic acid
CID 166151352
1-[2-(2-methoxy-4-methylphenoxy)phenyl]propan-1-one
CID 115994697

Frequently Asked Questions

What is the IUPAC name of (2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone?
The IUPAC name of (2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone (CID 106790144) is (2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone.
What is the SMILES notation for (2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone?
The canonical SMILES for (2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone is CCCOc1ccccc1C(=O)c1ccc(C)cc1OC.
What is the InChIKey of (2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone?
The InChIKey is QLGVSSPHGBOOQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O3/c1-4-11-21-16-8-6-5-7-14(16)18(19)15-10-9-13(2)12-17(15)20-3/h5-10,12H,4,11H2,1-3H3.
What are the key properties of (2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone?
(2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone has a molecular weight of 284.36 g/mol, XLogP of 4.02, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone is sourced from PubChem (CID 106790144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).