6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine

C13H12BrFN2 — CID 63963216

IUPAC6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine
SMILESFc1ccccc1CCNc1cccc(Br)n1
InChIInChI=1S/C13H12BrFN2/c14-12-6-3-7-13(17-12)16-9-8-10-4-1-2-5-11(10)15/h1-7H,8-9H2,(H,16,17)
InChIKeyNQUZDQBWSURNIC-UHFFFAOYSA-N
MW295.16 g/mol
LogP3.64
Rot. Bonds4

About 6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine

6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine (PubChem CID 63963216) has the molecular formula C13H12BrFN2 and a molecular weight of 295.16 g/mol. Its IUPAC name is 6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine
PubChem CID63963216
Molecular FormulaC13H12BrFN2
Molecular Weight295.16 g/mol
Exact Mass294.02
IUPAC Name6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine
SMILESFc1ccccc1CCNc1cccc(Br)n1
InChIInChI=1S/C13H12BrFN2/c14-12-6-3-7-13(17-12)16-9-8-10-4-1-2-5-11(10)15/h1-7H,8-9H2,(H,16,17)
InChIKeyNQUZDQBWSURNIC-UHFFFAOYSA-N
XLogP3.64
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.16
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-bromo-6-[(2-fluorophenyl)methyl]pyridine
CID 86652414
4-N-[2-(2-fluorophenyl)ethyl]-2-N-[(2-fluorophenyl)methyl]pyrimidine-2,4-diamine
CID 112891248
6-chloro-N-[2-(2-fluorophenyl)ethyl]-2-propan-2-ylpyrimidin-4-amine
CID 80954051
6-bromo-N-[(2-bromophenyl)methyl]pyridin-2-amine
CID 63962154
N-[2-(2-fluorophenyl)ethyl]-5,6-dimethylpyrazin-2-amine
CID 114475197
N-[2-(2-fluorophenyl)ethyl]-6-methylpyridazin-3-amine
CID 61311370
3-N-(2,6-difluorophenyl)-5-N-[2-(2-fluorophenyl)ethyl]-1,2,4-triazine-3,5-diamine
CID 112953498
6-chloro-4-N-[2-(2-fluorophenyl)ethyl]pyrimidine-2,4-diamine
CID 31537803
4-N-(4-bromophenyl)-6-N-[2-(2-fluorophenyl)ethyl]pyrimidine-4,6-diamine
CID 112861329
1,2-bis(6-bromo-2-pyridinyl)hydrazine
CID 167065966
N-[2-(2-fluorophenyl)ethyl]-6-propan-2-ylpyrimidin-4-amine
CID 61239779
5-bromo-N-[2-(2-fluorophenyl)ethyl]isoquinolin-1-amine
CID 106537294

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine?
The IUPAC name of 6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine (CID 63963216) is 6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine.
What is the SMILES notation for 6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine?
The canonical SMILES for 6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine is Fc1ccccc1CCNc1cccc(Br)n1.
What is the InChIKey of 6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine?
The InChIKey is NQUZDQBWSURNIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12BrFN2/c14-12-6-3-7-13(17-12)16-9-8-10-4-1-2-5-11(10)15/h1-7H,8-9H2,(H,16,17).
What are the key properties of 6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine?
6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine has a molecular weight of 295.16 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine is sourced from PubChem (CID 63963216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).