2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene

C24H25FO — CID 19906916

IUPAC2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene
SMILESCCCc1ccc(-c2ccc(CCc3ccc(OC)cc3)cc2F)cc1
InChIInChI=1S/C24H25FO/c1-3-4-18-7-12-21(13-8-18)23-16-11-20(17-24(23)25)6-5-19-9-14-22(26-2)15-10-19/h7-17H,3-6H2,1-2H3
InChIKeyQPXGIDNSDIAWOC-UHFFFAOYSA-N
MW348.46 g/mol
LogP6.24
Rot. Bonds7

About 2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene

2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene (PubChem CID 19906916) has the molecular formula C24H25FO and a molecular weight of 348.46 g/mol. Its IUPAC name is 2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene.

Molecular Properties

Compound Name2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene
PubChem CID19906916
Molecular FormulaC24H25FO
Molecular Weight348.46 g/mol
Exact Mass348.19
IUPAC Name2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene
SMILESCCCc1ccc(-c2ccc(CCc3ccc(OC)cc3)cc2F)cc1
InChIInChI=1S/C24H25FO/c1-3-4-18-7-12-21(13-8-18)23-16-11-20(17-24(23)25)6-5-19-9-14-22(26-2)15-10-19/h7-17H,3-6H2,1-2H3
InChIKeyQPXGIDNSDIAWOC-UHFFFAOYSA-N
XLogP6.24
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.46
LogP ≤ 56.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-ethyl-2-fluoro-1-(4-methoxyphenyl)benzene
CID 146522341
2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol
CID 134432733
butane;(2S)-2-[4-[2-[3-fluoro-4-[4-[(2R)-1-hydroxypropan-2-yl]oxyphenyl]phenyl]ethyl]phenoxy]propan-1-ol
CID 90725118
2,3-difluoro-1-(2-fluoro-4-propylphenyl)-4-[4-[2-(3,4,5-trifluorophenyl)ethyl]phenyl]benzene
CID 118858881
4-(2-fluoro-4-propylphenyl)phenol
CID 139457311
4-butyl-2-fluoro-1-[4-[2-(4-pentylphenyl)ethyl]phenyl]benzene
CID 19906913
2-fluoro-1-(4-heptylphenyl)-4-[2-(4-pentylphenyl)ethyl]benzene
CID 19906944
[4-(2-fluoro-4-propylphenyl)phenyl] (4-pentylphenyl) carbonate
CID 70483025
2,3-difluoro-1-[3-fluoro-4-(4-propylphenyl)phenyl]-4-methoxybenzene
CID 121369846
ethane;2-fluoro-4-(3-methoxybut-3-enyl)-1-(4-propylphenyl)benzene;hydrogen peroxide
CID 144914338
1-(4-butoxyphenyl)-2-fluoro-4-pentylbenzene
CID 67842431
4-bromo-2-fluoro-1-(4-propylphenyl)benzene
CID 22717506

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene?
The IUPAC name of 2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene (CID 19906916) is 2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene.
What is the SMILES notation for 2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene?
The canonical SMILES for 2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene is CCCc1ccc(-c2ccc(CCc3ccc(OC)cc3)cc2F)cc1.
What is the InChIKey of 2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene?
The InChIKey is QPXGIDNSDIAWOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25FO/c1-3-4-18-7-12-21(13-8-18)23-16-11-20(17-24(23)25)6-5-19-9-14-22(26-2)15-10-19/h7-17H,3-6H2,1-2H3.
What are the key properties of 2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene?
2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene has a molecular weight of 348.46 g/mol, XLogP of 6.24, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene is sourced from PubChem (CID 19906916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).