1-(5-fluoropentyl)-4-phenylbenzene

C17H19F — CID 20663493

IUPAC1-(5-fluoropentyl)-4-phenylbenzene
SMILESFCCCCCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C17H19F/c18-14-6-2-3-7-15-10-12-17(13-11-15)16-8-4-1-5-9-16/h1,4-5,8-13H,2-3,6-7,14H2
InChIKeyBEVXZPGKPWBDLK-UHFFFAOYSA-N
MW242.34 g/mol
LogP5.04
Rot. Bonds6

About 1-(5-fluoropentyl)-4-phenylbenzene

1-(5-fluoropentyl)-4-phenylbenzene (PubChem CID 20663493) has the molecular formula C17H19F and a molecular weight of 242.34 g/mol. Its IUPAC name is 1-(5-fluoropentyl)-4-phenylbenzene.

Molecular Properties

Compound Name1-(5-fluoropentyl)-4-phenylbenzene
PubChem CID20663493
Molecular FormulaC17H19F
Molecular Weight242.34 g/mol
Exact Mass242.15
IUPAC Name1-(5-fluoropentyl)-4-phenylbenzene
SMILESFCCCCCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C17H19F/c18-14-6-2-3-7-15-10-12-17(13-11-15)16-8-4-1-5-9-16/h1,4-5,8-13H,2-3,6-7,14H2
InChIKeyBEVXZPGKPWBDLK-UHFFFAOYSA-N
XLogP5.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500242.34
LogP ≤ 55.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(5-fluoropentyl)-4-phenylbenzene 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

1-pentadecyl-4-phenylbenzene
CID 57166115
1-(5-fluoropentyl)-4-methylbenzene
CID 172812127
4-(4-phenylphenyl)butan-1-ol
CID 11970468
1,3,5-tris(4-phenylphenyl)-2,4,6-tris(4-tetradecylphenyl)benzene
CID 132609480
2-fluoro-4-(4-fluorobutyl)-1-phenylbenzene
CID 20663568
1-hex-5-enyl-4-phenylbenzene
CID 59235470
1-butyl-4-phenylbenzene;ethane
CID 143743409
1,3-difluoro-5-[4-(7-fluoroheptyl)phenyl]-2-(4-methylphenyl)benzene
CID 20663476
4-phenylbutylbenzene
CID 141301927
1-butoxy-4-[4-(4-fluorobutyl)phenyl]benzene
CID 19789101
4-[4-(5-phenylpentyl)phenyl]benzonitrile
CID 101022686
4-methyl-1-[5-(4-phenylphenyl)pentyl]pyridin-1-ium bromide
CID 24781680

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoropentyl)-4-phenylbenzene?
The IUPAC name of 1-(5-fluoropentyl)-4-phenylbenzene (CID 20663493) is 1-(5-fluoropentyl)-4-phenylbenzene.
What is the SMILES notation for 1-(5-fluoropentyl)-4-phenylbenzene?
The canonical SMILES for 1-(5-fluoropentyl)-4-phenylbenzene is FCCCCCc1ccc(-c2ccccc2)cc1.
What is the InChIKey of 1-(5-fluoropentyl)-4-phenylbenzene?
The InChIKey is BEVXZPGKPWBDLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19F/c18-14-6-2-3-7-15-10-12-17(13-11-15)16-8-4-1-5-9-16/h1,4-5,8-13H,2-3,6-7,14H2.
What are the key properties of 1-(5-fluoropentyl)-4-phenylbenzene?
1-(5-fluoropentyl)-4-phenylbenzene has a molecular weight of 242.34 g/mol, XLogP of 5.04, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoropentyl)-4-phenylbenzene is sourced from PubChem (CID 20663493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).