(1,5-difluoro-4-phenylpentan-2-yl)benzene

C17H18F2 — CID 59266877

IUPAC(1,5-difluoro-4-phenylpentan-2-yl)benzene
SMILESFCC(CC(CF)c1ccccc1)c1ccccc1
InChIInChI=1S/C17H18F2/c18-12-16(14-7-3-1-4-8-14)11-17(13-19)15-9-5-2-6-10-15/h1-10,16-17H,11-13H2
InChIKeyRQRYTNYNYVJKRF-UHFFFAOYSA-N
MW260.33 g/mol
LogP4.88
Rot. Bonds6

About (1,5-difluoro-4-phenylpentan-2-yl)benzene

(1,5-difluoro-4-phenylpentan-2-yl)benzene (PubChem CID 59266877) has the molecular formula C17H18F2 and a molecular weight of 260.33 g/mol. Its IUPAC name is (1,5-difluoro-4-phenylpentan-2-yl)benzene.

Molecular Properties

Compound Name(1,5-difluoro-4-phenylpentan-2-yl)benzene
PubChem CID59266877
Molecular FormulaC17H18F2
Molecular Weight260.33 g/mol
Exact Mass260.14
IUPAC Name(1,5-difluoro-4-phenylpentan-2-yl)benzene
SMILESFCC(CC(CF)c1ccccc1)c1ccccc1
InChIInChI=1S/C17H18F2/c18-12-16(14-7-3-1-4-8-14)11-17(13-19)15-9-5-2-6-10-15/h1-10,16-17H,11-13H2
InChIKeyRQRYTNYNYVJKRF-UHFFFAOYSA-N
XLogP4.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.33
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (1,5-difluoro-4-phenylpentan-2-yl)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

3-fluoro-2-phenylpropane-1-thiol
CID 173255366
(4R)-5-fluoro-4-phenylpentan-2-one
CID 101477163
(1-fluoro-1-phenylpentan-3-yl)benzene
CID 150013028
4-phenylheptane-2,6-diol
CID 173150769
azane;pentan-3-ylbenzene
CID 19774895
(1-pentyl-3-phenylheptyl)benzene
CID 154153436
ethyl 4-fluoro-3-phenylbutanoate
CID 121436006
(2S,5S)-2,5-diphenylhexane-1,6-diol
CID 102169365
2-fluoroheptan-4-ylbenzene
CID 174378334
1,1-diphenylhexan-3-ylbenzene
CID 57087261
(6-methyl-4-phenylheptan-2-yl)benzene
CID 174190180
4,6-diphenylnonane-1,1-diol
CID 162161241

Frequently Asked Questions

What is the IUPAC name of (1,5-difluoro-4-phenylpentan-2-yl)benzene?
The IUPAC name of (1,5-difluoro-4-phenylpentan-2-yl)benzene (CID 59266877) is (1,5-difluoro-4-phenylpentan-2-yl)benzene.
What is the SMILES notation for (1,5-difluoro-4-phenylpentan-2-yl)benzene?
The canonical SMILES for (1,5-difluoro-4-phenylpentan-2-yl)benzene is FCC(CC(CF)c1ccccc1)c1ccccc1.
What is the InChIKey of (1,5-difluoro-4-phenylpentan-2-yl)benzene?
The InChIKey is RQRYTNYNYVJKRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18F2/c18-12-16(14-7-3-1-4-8-14)11-17(13-19)15-9-5-2-6-10-15/h1-10,16-17H,11-13H2.
What are the key properties of (1,5-difluoro-4-phenylpentan-2-yl)benzene?
(1,5-difluoro-4-phenylpentan-2-yl)benzene has a molecular weight of 260.33 g/mol, XLogP of 4.88, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1,5-difluoro-4-phenylpentan-2-yl)benzene is sourced from PubChem (CID 59266877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).