4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine

C14H19BrFN — CID 134367053

IUPAC4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine
SMILESFCCCN1CCC(c2ccc(Br)cc2)CC1
InChIInChI=1S/C14H19BrFN/c15-14-4-2-12(3-5-14)13-6-10-17(11-7-13)9-1-8-16/h2-5,13H,1,6-11H2
InChIKeyZUACUOMPRZFQPW-UHFFFAOYSA-N
MW300.21 g/mol
LogP3.99
Rot. Bonds4

About 4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine

4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine (PubChem CID 134367053) has the molecular formula C14H19BrFN and a molecular weight of 300.21 g/mol. Its IUPAC name is 4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine.

Molecular Properties

Compound Name4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine
PubChem CID134367053
Molecular FormulaC14H19BrFN
Molecular Weight300.21 g/mol
Exact Mass299.07
IUPAC Name4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine
SMILESFCCCN1CCC(c2ccc(Br)cc2)CC1
InChIInChI=1S/C14H19BrFN/c15-14-4-2-12(3-5-14)13-6-10-17(11-7-13)9-1-8-16/h2-5,13H,1,6-11H2
InChIKeyZUACUOMPRZFQPW-UHFFFAOYSA-N
XLogP3.99
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.21
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine?
The IUPAC name of 4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine (CID 134367053) is 4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine.
What is the SMILES notation for 4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine?
The canonical SMILES for 4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine is FCCCN1CCC(c2ccc(Br)cc2)CC1.
What is the InChIKey of 4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine?
The InChIKey is ZUACUOMPRZFQPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrFN/c15-14-4-2-12(3-5-14)13-6-10-17(11-7-13)9-1-8-16/h2-5,13H,1,6-11H2.
What are the key properties of 4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine?
4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine has a molecular weight of 300.21 g/mol, XLogP of 3.99, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-bromophenyl)-1-(3-fluoropropyl)piperidine is sourced from PubChem (CID 134367053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).