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

C15H15F — CID 90778447

IUPAC4-fluoro-2-methyl-1-(2-phenylethyl)benzene
SMILESCc1cc(F)ccc1CCc1ccccc1
InChIInChI=1S/C15H15F/c1-12-11-15(16)10-9-14(12)8-7-13-5-3-2-4-6-13/h2-6,9-11H,7-8H2,1H3
InChIKeyCSAGBQLKECFBNQ-UHFFFAOYSA-N
MW214.28 g/mol
LogP3.92
Rot. Bonds3

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

4-fluoro-2-methyl-1-(2-phenylethyl)benzene (PubChem CID 90778447) has the molecular formula C15H15F and a molecular weight of 214.28 g/mol. Its IUPAC name is 4-fluoro-2-methyl-1-(2-phenylethyl)benzene.

Molecular Properties

Compound Name4-fluoro-2-methyl-1-(2-phenylethyl)benzene
PubChem CID90778447
Molecular FormulaC15H15F
Molecular Weight214.28 g/mol
Exact Mass214.12
IUPAC Name4-fluoro-2-methyl-1-(2-phenylethyl)benzene
SMILESCc1cc(F)ccc1CCc1ccccc1
InChIInChI=1S/C15H15F/c1-12-11-15(16)10-9-14(12)8-7-13-5-3-2-4-6-13/h2-6,9-11H,7-8H2,1H3
InChIKeyCSAGBQLKECFBNQ-UHFFFAOYSA-N
XLogP3.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.28
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 4-fluoro-2-methyl-1-(2-phenylethyl)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

2,4-dimethyl-1-(2-phenylethyl)benzene;gold
CID 173364905
1-(4-fluoro-2-methylphenyl)-4-phenylbutan-2-amine
CID 114347745
2-methyl-1-(2-phenylethyl)-4-(trifluoromethyl)benzene
CID 91426393
1-(4-fluoro-2-methylphenyl)-3-phenylpropan-2-amine
CID 62720947
1-(2-bromoethyl)-4-fluoro-2-methylbenzene
CID 62802439
4-fluoro-2-methyl-1-pentylbenzene
CID 57094925
N-benzyl-2-bromo-N-[(4-fluoro-2-methylphenyl)methyl]ethanamine
CID 114349155
N-[(4-fluoro-2-methylphenyl)methyl]-1-phenylpropan-2-amine
CID 63012959
2-(4-fluoro-2-methylphenyl)acetic acid
CID 5016950
2-(4-fluoro-2-methylphenyl)ethylhydrazine
CID 105220815
4-(4-fluoro-2-methylphenyl)butan-1-ol
CID 54363918
2-(4-fluoro-2-methylphenyl)-1-phenylethanone
CID 114347156

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-methyl-1-(2-phenylethyl)benzene?
The IUPAC name of 4-fluoro-2-methyl-1-(2-phenylethyl)benzene (CID 90778447) is 4-fluoro-2-methyl-1-(2-phenylethyl)benzene.
What is the SMILES notation for 4-fluoro-2-methyl-1-(2-phenylethyl)benzene?
The canonical SMILES for 4-fluoro-2-methyl-1-(2-phenylethyl)benzene is Cc1cc(F)ccc1CCc1ccccc1.
What is the InChIKey of 4-fluoro-2-methyl-1-(2-phenylethyl)benzene?
The InChIKey is CSAGBQLKECFBNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F/c1-12-11-15(16)10-9-14(12)8-7-13-5-3-2-4-6-13/h2-6,9-11H,7-8H2,1H3.
What are the key properties of 4-fluoro-2-methyl-1-(2-phenylethyl)benzene?
4-fluoro-2-methyl-1-(2-phenylethyl)benzene has a molecular weight of 214.28 g/mol, XLogP of 3.92, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-methyl-1-(2-phenylethyl)benzene is sourced from PubChem (CID 90778447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).