2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene

C16H17FO2 — CID 107662038

IUPAC2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene
SMILESCOc1ccc(C)cc1COc1cccc(C)c1F
InChIInChI=1S/C16H17FO2/c1-11-7-8-14(18-3)13(9-11)10-19-15-6-4-5-12(2)16(15)17/h4-9H,10H2,1-3H3
InChIKeyGWBPHKDWARLYFA-UHFFFAOYSA-N
MW260.31 g/mol
LogP4.03
Rot. Bonds4

About 2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene

2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene (PubChem CID 107662038) has the molecular formula C16H17FO2 and a molecular weight of 260.31 g/mol. Its IUPAC name is 2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene.

Molecular Properties

Compound Name2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene
PubChem CID107662038
Molecular FormulaC16H17FO2
Molecular Weight260.31 g/mol
Exact Mass260.12
IUPAC Name2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene
SMILESCOc1ccc(C)cc1COc1cccc(C)c1F
InChIInChI=1S/C16H17FO2/c1-11-7-8-14(18-3)13(9-11)10-19-15-6-4-5-12(2)16(15)17/h4-9H,10H2,1-3H3
InChIKeyGWBPHKDWARLYFA-UHFFFAOYSA-N
XLogP4.03
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-1-[(2-methoxy-5-nitrophenyl)methoxy]-3-methylbenzene
CID 103988326
2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene
CID 64766047
2-[[2-(chloromethyl)phenoxy]methyl]-1-methoxy-4-methylbenzene
CID 62161146
3-[(2-methoxy-5-methylphenyl)methoxy]phenol
CID 62159960
1-(2-fluoro-3-methylphenyl)-2-(2-methoxy-5-methylphenyl)ethanamine
CID 115826307
1,2-difluoro-3-[(2-fluoro-3-methylphenoxy)methyl]benzene
CID 107661926
3-[(2-methoxy-5-methylphenyl)methoxy]aniline
CID 61034710
2-[(3-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene
CID 64765116
1-[[2-(chloromethyl)-4-methylphenoxy]methyl]-2,3-difluorobenzene
CID 55224386
N-[1-[2-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethylidene]hydroxylamine
CID 76936776
1,4-dimethyl-2-[(2-methylphenoxy)methyl]benzene
CID 60627928
2-(chloromethyl)-1-[(2,5-dimethylphenyl)methoxy]-4-fluorobenzene
CID 107698706

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene?
The IUPAC name of 2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene (CID 107662038) is 2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene.
What is the SMILES notation for 2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene?
The canonical SMILES for 2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene is COc1ccc(C)cc1COc1cccc(C)c1F.
What is the InChIKey of 2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene?
The InChIKey is GWBPHKDWARLYFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FO2/c1-11-7-8-14(18-3)13(9-11)10-19-15-6-4-5-12(2)16(15)17/h4-9H,10H2,1-3H3.
What are the key properties of 2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene?
2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene has a molecular weight of 260.31 g/mol, XLogP of 4.03, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene is sourced from PubChem (CID 107662038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).