(2-fluoro-6-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone

C17H17FO3 — CID 103432999

IUPAC(2-fluoro-6-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone
SMILESCOc1cccc(F)c1C(=O)c1ccc(C)c(C)c1OC
InChIInChI=1S/C17H17FO3/c1-10-8-9-12(17(21-4)11(10)2)16(19)15-13(18)6-5-7-14(15)20-3/h5-9H,1-4H3
InChIKeyBMDHYXQFNKSIKI-UHFFFAOYSA-N
MW288.32 g/mol
LogP3.69
Rot. Bonds4

About (2-fluoro-6-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone

(2-fluoro-6-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone (PubChem CID 103432999) has the molecular formula C17H17FO3 and a molecular weight of 288.32 g/mol. Its IUPAC name is (2-fluoro-6-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone.

Molecular Properties

Compound Name(2-fluoro-6-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone
PubChem CID103432999
Molecular FormulaC17H17FO3
Molecular Weight288.32 g/mol
Exact Mass288.12
IUPAC Name(2-fluoro-6-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone
SMILESCOc1cccc(F)c1C(=O)c1ccc(C)c(C)c1OC
InChIInChI=1S/C17H17FO3/c1-10-8-9-12(17(21-4)11(10)2)16(19)15-13(18)6-5-7-14(15)20-3/h5-9H,1-4H3
InChIKeyBMDHYXQFNKSIKI-UHFFFAOYSA-N
XLogP3.69
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.32
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3-chloro-2-fluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanone
CID 103432923
(4-fluoro-3,5-dimethylphenyl)-(2-fluoro-6-methoxyphenyl)methanone
CID 65433422
(3-chloro-4-methylphenyl)-(2-fluoro-6-methoxyphenyl)methanone
CID 113241963
(2-fluoro-6-methoxyphenyl)-(2-hydroxy-6-methoxyphenyl)methanone
CID 14629523
(3,4-dimethylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone
CID 103435101
(3-bromo-2-fluorophenyl)-(2-fluoro-6-methoxyphenyl)methanone
CID 106644895
(2-ethoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone
CID 103433024
(3,5-difluorophenyl)-(2-fluoro-6-methoxyphenyl)methanone
CID 79020458
2,2-difluoro-1-(2-methoxy-3,4-dimethylphenyl)ethanone
CID 103433037
(2-fluoro-6-methoxyphenyl)-isoquinolin-8-ylmethanone
CID 103134021
(2-chloro-4-fluoro-5-methylphenyl)-(2,6-dimethoxyphenyl)methanone
CID 81047587
(4-amino-3-fluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanone
CID 103434759

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-6-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone?
The IUPAC name of (2-fluoro-6-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone (CID 103432999) is (2-fluoro-6-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone.
What is the SMILES notation for (2-fluoro-6-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone?
The canonical SMILES for (2-fluoro-6-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone is COc1cccc(F)c1C(=O)c1ccc(C)c(C)c1OC.
What is the InChIKey of (2-fluoro-6-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone?
The InChIKey is BMDHYXQFNKSIKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FO3/c1-10-8-9-12(17(21-4)11(10)2)16(19)15-13(18)6-5-7-14(15)20-3/h5-9H,1-4H3.
What are the key properties of (2-fluoro-6-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone?
(2-fluoro-6-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone has a molecular weight of 288.32 g/mol, XLogP of 3.69, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-6-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone is sourced from PubChem (CID 103432999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).