4-fluoro-2-methyl-1-(2-methylphenoxy)benzene

C14H13FO — CID 69045546

IUPAC4-fluoro-2-methyl-1-(2-methylphenoxy)benzene
SMILESCc1ccccc1Oc1ccc(F)cc1C
InChIInChI=1S/C14H13FO/c1-10-5-3-4-6-13(10)16-14-8-7-12(15)9-11(14)2/h3-9H,1-2H3
InChIKeyYZERXOWWOASJDP-UHFFFAOYSA-N
MW216.25 g/mol
LogP4.23
Rot. Bonds2

About 4-fluoro-2-methyl-1-(2-methylphenoxy)benzene

4-fluoro-2-methyl-1-(2-methylphenoxy)benzene (PubChem CID 69045546) has the molecular formula C14H13FO and a molecular weight of 216.25 g/mol. Its IUPAC name is 4-fluoro-2-methyl-1-(2-methylphenoxy)benzene.

Molecular Properties

Compound Name4-fluoro-2-methyl-1-(2-methylphenoxy)benzene
PubChem CID69045546
Molecular FormulaC14H13FO
Molecular Weight216.25 g/mol
Exact Mass216.10
IUPAC Name4-fluoro-2-methyl-1-(2-methylphenoxy)benzene
SMILESCc1ccccc1Oc1ccc(F)cc1C
InChIInChI=1S/C14H13FO/c1-10-5-3-4-6-13(10)16-14-8-7-12(15)9-11(14)2/h3-9H,1-2H3
InChIKeyYZERXOWWOASJDP-UHFFFAOYSA-N
XLogP4.23
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.25
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-fluoro-2-methyl-1-(2-methylphenoxy)benzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;1-methyl-2-(2-methylphenoxy)benzene
CID 90755051
4-chloro-2-methyl-1-(2-methylphenoxy)benzene
CID 62706685
2-(4-fluoro-2-methylphenoxy)-3-methylaniline
CID 68879061
ethane;4-fluoro-1-methoxy-2-methylbenzene
CID 143329013
1-[3-(4-fluoro-2-methylphenoxy)-4-methylphenyl]-N-methylmethanamine
CID 105407476
(4-fluoro-2-methylphenoxy)boronic acid
CID 14579594
2-(4-fluoro-2-methylphenoxy)-4,5-dimethoxyaniline
CID 83008312
2-(4-fluoro-2-methylphenoxy)-5-methylbenzonitrile
CID 114017002
1,2,3-tris(2-methylphenoxy)benzene
CID 139940567
4-fluoro-2-methyl-1-propan-2-yloxybenzene
CID 58970665
1-(difluoromethoxy)-4-fluoro-2-methylbenzene
CID 46311597
1,4-dimethoxy-2-(2-methylphenoxy)benzene
CID 173173641

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-methyl-1-(2-methylphenoxy)benzene?
The IUPAC name of 4-fluoro-2-methyl-1-(2-methylphenoxy)benzene (CID 69045546) is 4-fluoro-2-methyl-1-(2-methylphenoxy)benzene.
What is the SMILES notation for 4-fluoro-2-methyl-1-(2-methylphenoxy)benzene?
The canonical SMILES for 4-fluoro-2-methyl-1-(2-methylphenoxy)benzene is Cc1ccccc1Oc1ccc(F)cc1C.
What is the InChIKey of 4-fluoro-2-methyl-1-(2-methylphenoxy)benzene?
The InChIKey is YZERXOWWOASJDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FO/c1-10-5-3-4-6-13(10)16-14-8-7-12(15)9-11(14)2/h3-9H,1-2H3.
What are the key properties of 4-fluoro-2-methyl-1-(2-methylphenoxy)benzene?
4-fluoro-2-methyl-1-(2-methylphenoxy)benzene has a molecular weight of 216.25 g/mol, XLogP of 4.23, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-methyl-1-(2-methylphenoxy)benzene is sourced from PubChem (CID 69045546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).