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

C11H14BrFN2 — CID 107632991

IUPACN-(2-bromo-5-fluorophenyl)piperidin-4-amine
SMILESFc1ccc(Br)c(NC2CCNCC2)c1
InChIInChI=1S/C11H14BrFN2/c12-10-2-1-8(13)7-11(10)15-9-3-5-14-6-4-9/h1-2,7,9,14-15H,3-6H2
InChIKeyLWMMFLFPRQAMFI-UHFFFAOYSA-N
MW273.15 g/mol
LogP2.75
Rot. Bonds2

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

N-(2-bromo-5-fluorophenyl)piperidin-4-amine (PubChem CID 107632991) has the molecular formula C11H14BrFN2 and a molecular weight of 273.15 g/mol. Its IUPAC name is N-(2-bromo-5-fluorophenyl)piperidin-4-amine.

Molecular Properties

Compound NameN-(2-bromo-5-fluorophenyl)piperidin-4-amine
PubChem CID107632991
Molecular FormulaC11H14BrFN2
Molecular Weight273.15 g/mol
Exact Mass272.03
IUPAC NameN-(2-bromo-5-fluorophenyl)piperidin-4-amine
SMILESFc1ccc(Br)c(NC2CCNCC2)c1
InChIInChI=1S/C11H14BrFN2/c12-10-2-1-8(13)7-11(10)15-9-3-5-14-6-4-9/h1-2,7,9,14-15H,3-6H2
InChIKeyLWMMFLFPRQAMFI-UHFFFAOYSA-N
XLogP2.75
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.15
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-N-cyclobutyl-5-fluoroaniline
CID 107633201
N-(2-bromo-5-fluorophenyl)-3,3-dimethylpiperidin-4-amine
CID 114235564
N-(2-bromo-5-fluorophenyl)oxolan-3-amine
CID 107633205
N-(2,5-difluorophenyl)pyrrolidin-3-amine
CID 79737094
N-(2-bromo-5-fluorophenyl)piperidine-4-sulfonamide
CID 107626850
N-(4-bromo-2-fluorophenyl)piperidin-4-amine
CID 61016241
N-(2-bromo-5-fluorophenyl)-1,1-dioxothiolan-3-amine
CID 107633424
N-(2-bromo-5-chlorophenyl)pyrrolidin-3-amine
CID 81264104
N-[2-bromo-5-(trifluoromethyl)phenyl]pyrrolidin-3-amine
CID 114042706
4-(2-bromo-5-fluorophenyl)piperidine
CID 84709377
2-bromo-N-[4-[tert-butyl(dimethyl)silyl]oxycyclohexyl]-5-fluoroaniline
CID 170754007
N-(2,4-difluorophenyl)pyrrolidin-3-amine
CID 66545630

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-5-fluorophenyl)piperidin-4-amine?
The IUPAC name of N-(2-bromo-5-fluorophenyl)piperidin-4-amine (CID 107632991) is N-(2-bromo-5-fluorophenyl)piperidin-4-amine.
What is the SMILES notation for N-(2-bromo-5-fluorophenyl)piperidin-4-amine?
The canonical SMILES for N-(2-bromo-5-fluorophenyl)piperidin-4-amine is Fc1ccc(Br)c(NC2CCNCC2)c1.
What is the InChIKey of N-(2-bromo-5-fluorophenyl)piperidin-4-amine?
The InChIKey is LWMMFLFPRQAMFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrFN2/c12-10-2-1-8(13)7-11(10)15-9-3-5-14-6-4-9/h1-2,7,9,14-15H,3-6H2.
What are the key properties of N-(2-bromo-5-fluorophenyl)piperidin-4-amine?
N-(2-bromo-5-fluorophenyl)piperidin-4-amine has a molecular weight of 273.15 g/mol, XLogP of 2.75, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-5-fluorophenyl)piperidin-4-amine is sourced from PubChem (CID 107632991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).