1-(5-bromo-2-fluorophenyl)piperidin-4-amine

C11H14BrFN2 — CID 43555767

IUPAC1-(5-bromo-2-fluorophenyl)piperidin-4-amine
SMILESNC1CCN(c2cc(Br)ccc2F)CC1
InChIInChI=1S/C11H14BrFN2/c12-8-1-2-10(13)11(7-8)15-5-3-9(14)4-6-15/h1-2,7,9H,3-6,14H2
InChIKeyRKIUCDNVEKKCIS-UHFFFAOYSA-N
MW273.15 g/mol
LogP2.52
Rot. Bonds1

About 1-(5-bromo-2-fluorophenyl)piperidin-4-amine

1-(5-bromo-2-fluorophenyl)piperidin-4-amine (PubChem CID 43555767) has the molecular formula C11H14BrFN2 and a molecular weight of 273.15 g/mol. Its IUPAC name is 1-(5-bromo-2-fluorophenyl)piperidin-4-amine.

Molecular Properties

Compound Name1-(5-bromo-2-fluorophenyl)piperidin-4-amine
PubChem CID43555767
Molecular FormulaC11H14BrFN2
Molecular Weight273.15 g/mol
Exact Mass272.03
IUPAC Name1-(5-bromo-2-fluorophenyl)piperidin-4-amine
SMILESNC1CCN(c2cc(Br)ccc2F)CC1
InChIInChI=1S/C11H14BrFN2/c12-8-1-2-10(13)11(7-8)15-5-3-9(14)4-6-15/h1-2,7,9H,3-6,14H2
InChIKeyRKIUCDNVEKKCIS-UHFFFAOYSA-N
XLogP2.52
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.15
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(5-bromo-2-fluorophenyl)piperidin-4-amine 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 1-(5-bromo-2-fluorophenyl)piperidin-4-amine?
The IUPAC name of 1-(5-bromo-2-fluorophenyl)piperidin-4-amine (CID 43555767) is 1-(5-bromo-2-fluorophenyl)piperidin-4-amine.
What is the SMILES notation for 1-(5-bromo-2-fluorophenyl)piperidin-4-amine?
The canonical SMILES for 1-(5-bromo-2-fluorophenyl)piperidin-4-amine is NC1CCN(c2cc(Br)ccc2F)CC1.
What is the InChIKey of 1-(5-bromo-2-fluorophenyl)piperidin-4-amine?
The InChIKey is RKIUCDNVEKKCIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrFN2/c12-8-1-2-10(13)11(7-8)15-5-3-9(14)4-6-15/h1-2,7,9H,3-6,14H2.
What are the key properties of 1-(5-bromo-2-fluorophenyl)piperidin-4-amine?
1-(5-bromo-2-fluorophenyl)piperidin-4-amine has a molecular weight of 273.15 g/mol, XLogP of 2.52, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-2-fluorophenyl)piperidin-4-amine is sourced from PubChem (CID 43555767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).