(2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone

C16H15FO4 — CID 43339638

IUPAC(2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone
SMILESCOc1ccc(C(=O)c2cc(F)ccc2OC)c(OC)c1
InChIInChI=1S/C16H15FO4/c1-19-11-5-6-12(15(9-11)21-3)16(18)13-8-10(17)4-7-14(13)20-2/h4-9H,1-3H3
InChIKeyYWVVSHWYDHCPHJ-UHFFFAOYSA-N
MW290.29 g/mol
LogP3.08
Rot. Bonds5

About (2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone

(2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone (PubChem CID 43339638) has the molecular formula C16H15FO4 and a molecular weight of 290.29 g/mol. Its IUPAC name is (2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone.

Molecular Properties

Compound Name(2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone
PubChem CID43339638
Molecular FormulaC16H15FO4
Molecular Weight290.29 g/mol
Exact Mass290.10
IUPAC Name(2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone
SMILESCOc1ccc(C(=O)c2cc(F)ccc2OC)c(OC)c1
InChIInChI=1S/C16H15FO4/c1-19-11-5-6-12(15(9-11)21-3)16(18)13-8-10(17)4-7-14(13)20-2/h4-9H,1-3H3
InChIKeyYWVVSHWYDHCPHJ-UHFFFAOYSA-N
XLogP3.08
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.29
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2-bromo-4-fluorophenyl)-(5-fluoro-2-methoxyphenyl)methanone
CID 43339651
(5-fluoro-2-methoxyphenyl)-(2,3,4-trifluorophenyl)methanone
CID 56980668
(2-fluoro-4-methoxyphenyl)-(2-methoxyphenyl)methanone
CID 43561172
(5-chloro-2-methoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone
CID 43339633
(5-fluoro-2-methoxyphenyl)-(3-fluorophenyl)methanone
CID 43339656
(5-chloro-2-methoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanone
CID 43561116
(2-bromo-5-fluorophenyl)-(2-bromo-4-methoxyphenyl)methanone
CID 60788123
(2,5-difluorophenyl)-(2-methoxy-5-methylphenyl)methanone
CID 62504204
(4-bromo-2-methylphenyl)-(5-fluoro-2-methoxyphenyl)methanone
CID 43629665
[2-(difluoromethoxy)phenyl]-(5-fluoro-2-methoxyphenyl)methanone
CID 43339634
2-(2,4-difluorophenoxy)-1-(2,4-dimethoxyphenyl)ethanone
CID 78790506
1-[2-(2,4-dimethoxyphenyl)-5-fluorophenyl]ethanone
CID 175647044

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone?
The IUPAC name of (2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone (CID 43339638) is (2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone.
What is the SMILES notation for (2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone?
The canonical SMILES for (2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone is COc1ccc(C(=O)c2cc(F)ccc2OC)c(OC)c1.
What is the InChIKey of (2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone?
The InChIKey is YWVVSHWYDHCPHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FO4/c1-19-11-5-6-12(15(9-11)21-3)16(18)13-8-10(17)4-7-14(13)20-2/h4-9H,1-3H3.
What are the key properties of (2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone?
(2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone has a molecular weight of 290.29 g/mol, XLogP of 3.08, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone is sourced from PubChem (CID 43339638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).