1-[2-(4-fluorophenyl)-5-methoxyphenyl]ethanone

C15H13FO2 — CID 175647071

IUPAC1-[2-(4-fluorophenyl)-5-methoxyphenyl]ethanone
SMILESCOc1ccc(-c2ccc(F)cc2)c(C(C)=O)c1
InChIInChI=1S/C15H13FO2/c1-10(17)15-9-13(18-2)7-8-14(15)11-3-5-12(16)6-4-11/h3-9H,1-2H3
InChIKeyBOKYFNPSZQDBLF-UHFFFAOYSA-N
MW244.26 g/mol
LogP3.70
Rot. Bonds3

About 1-[2-(4-fluorophenyl)-5-methoxyphenyl]ethanone

1-[2-(4-fluorophenyl)-5-methoxyphenyl]ethanone (PubChem CID 175647071) has the molecular formula C15H13FO2 and a molecular weight of 244.26 g/mol. Its IUPAC name is 1-[2-(4-fluorophenyl)-5-methoxyphenyl]ethanone.

Molecular Properties

Compound Name1-[2-(4-fluorophenyl)-5-methoxyphenyl]ethanone
PubChem CID175647071
Molecular FormulaC15H13FO2
Molecular Weight244.26 g/mol
Exact Mass244.09
IUPAC Name1-[2-(4-fluorophenyl)-5-methoxyphenyl]ethanone
SMILESCOc1ccc(-c2ccc(F)cc2)c(C(C)=O)c1
InChIInChI=1S/C15H13FO2/c1-10(17)15-9-13(18-2)7-8-14(15)11-3-5-12(16)6-4-11/h3-9H,1-2H3
InChIKeyBOKYFNPSZQDBLF-UHFFFAOYSA-N
XLogP3.70
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.26
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-fluorophenyl)-5-methoxybenzoic acid
CID 15461737
1-[2-(2,4-dimethoxyphenyl)-5-fluorophenyl]ethanone
CID 175647044
1-[2-(2,5-dimethoxyphenyl)-5-fluorophenyl]ethanone
CID 175647048
1-[5-fluoro-2-(4-methylphenyl)phenyl]ethanone
CID 175647024
5-methoxy-2-(4-methoxyphenyl)benzoic acid
CID 2060525
2-fluoro-1-(4-fluorophenyl)-4-methoxybenzene
CID 46312221
1-[2,5-bis[4-(4-fluorobenzoyl)phenyl]phenyl]ethanone
CID 58769516
1-[2-(4-fluorophenyl)-4-methoxyphenyl]propan-1-one
CID 174581854
1-[5-(4-fluorophenyl)-4-(4-methoxyphenyl)thiophen-2-yl]ethanone
CID 23372664
methyl 4-[2-acetyl-4-(4-methoxyphenyl)phenyl]benzoate
CID 146165919
1-[2-(3,4-difluorophenyl)-4-methoxyphenyl]ethanone
CID 139791589
5-methoxy-2-[4-(trifluoromethoxy)phenyl]benzoic acid
CID 53228264

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-fluorophenyl)-5-methoxyphenyl]ethanone?
The IUPAC name of 1-[2-(4-fluorophenyl)-5-methoxyphenyl]ethanone (CID 175647071) is 1-[2-(4-fluorophenyl)-5-methoxyphenyl]ethanone.
What is the SMILES notation for 1-[2-(4-fluorophenyl)-5-methoxyphenyl]ethanone?
The canonical SMILES for 1-[2-(4-fluorophenyl)-5-methoxyphenyl]ethanone is COc1ccc(-c2ccc(F)cc2)c(C(C)=O)c1.
What is the InChIKey of 1-[2-(4-fluorophenyl)-5-methoxyphenyl]ethanone?
The InChIKey is BOKYFNPSZQDBLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FO2/c1-10(17)15-9-13(18-2)7-8-14(15)11-3-5-12(16)6-4-11/h3-9H,1-2H3.
What are the key properties of 1-[2-(4-fluorophenyl)-5-methoxyphenyl]ethanone?
1-[2-(4-fluorophenyl)-5-methoxyphenyl]ethanone has a molecular weight of 244.26 g/mol, XLogP of 3.70, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-fluorophenyl)-5-methoxyphenyl]ethanone is sourced from PubChem (CID 175647071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).