2-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran

C13H13FO2 — CID 102990526

IUPAC2-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran
SMILESCc1ccc(COc2cc(F)ccc2C)o1
InChIInChI=1S/C13H13FO2/c1-9-3-5-11(14)7-13(9)15-8-12-6-4-10(2)16-12/h3-7H,8H2,1-2H3
InChIKeyVZYIZIFGBSNKPM-UHFFFAOYSA-N
MW220.24 g/mol
LogP3.61
Rot. Bonds3

About 2-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran

2-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran (PubChem CID 102990526) has the molecular formula C13H13FO2 and a molecular weight of 220.24 g/mol. Its IUPAC name is 2-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran.

Molecular Properties

Compound Name2-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran
PubChem CID102990526
Molecular FormulaC13H13FO2
Molecular Weight220.24 g/mol
Exact Mass220.09
IUPAC Name2-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran
SMILESCc1ccc(COc2cc(F)ccc2C)o1
InChIInChI=1S/C13H13FO2/c1-9-3-5-11(14)7-13(9)15-8-12-6-4-10(2)16-12/h3-7H,8H2,1-2H3
InChIKeyVZYIZIFGBSNKPM-UHFFFAOYSA-N
XLogP3.61
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.24
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[5-[(5-fluoro-2-methylphenoxy)methyl]furan-2-yl]-N-methylmethanamine
CID 102980972
2-[(5-methylfuran-2-yl)methoxy]phenol
CID 43143474
5-[(5-fluoro-2-methylphenoxy)methyl]-2-methylfuran-3-carbohydrazide
CID 102987684
N-[[5-[(5-fluoro-2-methylphenoxy)methyl]-2-methylfuran-3-yl]methyl]propan-1-amine
CID 102986614
N-[[5-[(5-fluoro-2-methylphenoxy)methyl]-3-methylfuran-2-yl]methyl]cyclopropanamine
CID 102986645
5-[(5-fluoro-2-methylphenoxy)methyl]-1,3-thiazole
CID 102990539
1-[5-[(2,5-difluorophenoxy)methyl]-3-methylfuran-2-yl]-N-methylmethanamine
CID 63272857
3-bromo-2-[(5-fluoro-2-methylphenoxy)methyl]aniline
CID 102980462
1-bromo-2-[(5-fluoro-2-methylphenoxy)methyl]-4-methoxybenzene
CID 102983162
2-[4-[(5-fluoro-2-methylphenoxy)methyl]phenyl]ethanamine
CID 102986660
4-methoxy-2-[(5-methylfuran-2-yl)methoxy]benzoic acid
CID 61379364
2-bromo-3-[(5-fluoro-2-methylphenoxy)methyl]aniline
CID 114048616

Frequently Asked Questions

What is the IUPAC name of 2-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran?
The IUPAC name of 2-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran (CID 102990526) is 2-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran.
What is the SMILES notation for 2-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran?
The canonical SMILES for 2-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran is Cc1ccc(COc2cc(F)ccc2C)o1.
What is the InChIKey of 2-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran?
The InChIKey is VZYIZIFGBSNKPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FO2/c1-9-3-5-11(14)7-13(9)15-8-12-6-4-10(2)16-12/h3-7H,8H2,1-2H3.
What are the key properties of 2-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran?
2-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran has a molecular weight of 220.24 g/mol, XLogP of 3.61, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-fluoro-2-methylphenoxy)methyl]-5-methylfuran is sourced from PubChem (CID 102990526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).