3-chloro-5-fluoropyridin-4-amine

C5H4ClFN2 — CID 53485487

IUPAC3-chloro-5-fluoropyridin-4-amine
SMILESNc1c(F)cncc1Cl
InChIInChI=1S/C5H4ClFN2/c6-3-1-9-2-4(7)5(3)8/h1-2H,(H2,8,9)
InChIKeyLXGNBQKBHVHVCC-UHFFFAOYSA-N
MW146.55 g/mol
LogP1.46
Rot. Bonds

About 3-chloro-5-fluoropyridin-4-amine

3-chloro-5-fluoropyridin-4-amine (PubChem CID 53485487) has the molecular formula C5H4ClFN2 and a molecular weight of 146.55 g/mol. Its IUPAC name is 3-chloro-5-fluoropyridin-4-amine.

Molecular Properties

Compound Name3-chloro-5-fluoropyridin-4-amine
PubChem CID53485487
Molecular FormulaC5H4ClFN2
Molecular Weight146.55 g/mol
Exact Mass146.00
IUPAC Name3-chloro-5-fluoropyridin-4-amine
SMILESNc1c(F)cncc1Cl
InChIInChI=1S/C5H4ClFN2/c6-3-1-9-2-4(7)5(3)8/h1-2H,(H2,8,9)
InChIKeyLXGNBQKBHVHVCC-UHFFFAOYSA-N
XLogP1.46
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.55
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-fluoropyridin-4-amine?
The IUPAC name of 3-chloro-5-fluoropyridin-4-amine (CID 53485487) is 3-chloro-5-fluoropyridin-4-amine.
What is the SMILES notation for 3-chloro-5-fluoropyridin-4-amine?
The canonical SMILES for 3-chloro-5-fluoropyridin-4-amine is Nc1c(F)cncc1Cl.
What is the InChIKey of 3-chloro-5-fluoropyridin-4-amine?
The InChIKey is LXGNBQKBHVHVCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4ClFN2/c6-3-1-9-2-4(7)5(3)8/h1-2H,(H2,8,9).
What are the key properties of 3-chloro-5-fluoropyridin-4-amine?
3-chloro-5-fluoropyridin-4-amine has a molecular weight of 146.55 g/mol, XLogP of 1.46, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-fluoropyridin-4-amine is sourced from PubChem (CID 53485487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).