5-bromo-4-(1-fluoroethyl)pyridin-3-amine

C7H8BrFN2 — CID 142503258

IUPAC5-bromo-4-(1-fluoroethyl)pyridin-3-amine
SMILESCC(F)c1c(N)cncc1Br
InChIInChI=1S/C7H8BrFN2/c1-4(9)7-5(8)2-11-3-6(7)10/h2-4H,10H2,1H3
InChIKeySKUFTWFNKGPRRH-UHFFFAOYSA-N
MW219.06 g/mol
LogP2.46
Rot. Bonds1

About 5-bromo-4-(1-fluoroethyl)pyridin-3-amine

5-bromo-4-(1-fluoroethyl)pyridin-3-amine (PubChem CID 142503258) has the molecular formula C7H8BrFN2 and a molecular weight of 219.06 g/mol. Its IUPAC name is 5-bromo-4-(1-fluoroethyl)pyridin-3-amine.

Molecular Properties

Compound Name5-bromo-4-(1-fluoroethyl)pyridin-3-amine
PubChem CID142503258
Molecular FormulaC7H8BrFN2
Molecular Weight219.06 g/mol
Exact Mass217.99
IUPAC Name5-bromo-4-(1-fluoroethyl)pyridin-3-amine
SMILESCC(F)c1c(N)cncc1Br
InChIInChI=1S/C7H8BrFN2/c1-4(9)7-5(8)2-11-3-6(7)10/h2-4H,10H2,1H3
InChIKeySKUFTWFNKGPRRH-UHFFFAOYSA-N
XLogP2.46
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.06
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-bromo-4-(1-fluoroethyl)pyridin-3-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 5-bromo-4-(1-fluoroethyl)pyridin-3-amine?
The IUPAC name of 5-bromo-4-(1-fluoroethyl)pyridin-3-amine (CID 142503258) is 5-bromo-4-(1-fluoroethyl)pyridin-3-amine.
What is the SMILES notation for 5-bromo-4-(1-fluoroethyl)pyridin-3-amine?
The canonical SMILES for 5-bromo-4-(1-fluoroethyl)pyridin-3-amine is CC(F)c1c(N)cncc1Br.
What is the InChIKey of 5-bromo-4-(1-fluoroethyl)pyridin-3-amine?
The InChIKey is SKUFTWFNKGPRRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8BrFN2/c1-4(9)7-5(8)2-11-3-6(7)10/h2-4H,10H2,1H3.
What are the key properties of 5-bromo-4-(1-fluoroethyl)pyridin-3-amine?
5-bromo-4-(1-fluoroethyl)pyridin-3-amine has a molecular weight of 219.06 g/mol, XLogP of 2.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-(1-fluoroethyl)pyridin-3-amine is sourced from PubChem (CID 142503258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).