2-chloro-5-fluoropyridin-3-amine

C5H4ClFN2 — CID 44754868

IUPAC2-chloro-5-fluoropyridin-3-amine
SMILESNc1cc(F)cnc1Cl
InChIInChI=1S/C5H4ClFN2/c6-5-4(8)1-3(7)2-9-5/h1-2H,8H2
InChIKeyMSCZFRUXABFTJN-UHFFFAOYSA-N
MW146.55 g/mol
LogP1.46
Rot. Bonds

About 2-chloro-5-fluoropyridin-3-amine

2-chloro-5-fluoropyridin-3-amine (PubChem CID 44754868) has the molecular formula C5H4ClFN2 and a molecular weight of 146.55 g/mol. Its IUPAC name is 2-chloro-5-fluoropyridin-3-amine.

Molecular Properties

Compound Name2-chloro-5-fluoropyridin-3-amine
PubChem CID44754868
Molecular FormulaC5H4ClFN2
Molecular Weight146.55 g/mol
Exact Mass146.00
IUPAC Name2-chloro-5-fluoropyridin-3-amine
SMILESNc1cc(F)cnc1Cl
InChIInChI=1S/C5H4ClFN2/c6-5-4(8)1-3(7)2-9-5/h1-2H,8H2
InChIKeyMSCZFRUXABFTJN-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

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-fluoropyridin-3-amine?
The IUPAC name of 2-chloro-5-fluoropyridin-3-amine (CID 44754868) is 2-chloro-5-fluoropyridin-3-amine.
What is the SMILES notation for 2-chloro-5-fluoropyridin-3-amine?
The canonical SMILES for 2-chloro-5-fluoropyridin-3-amine is Nc1cc(F)cnc1Cl.
What is the InChIKey of 2-chloro-5-fluoropyridin-3-amine?
The InChIKey is MSCZFRUXABFTJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4ClFN2/c6-5-4(8)1-3(7)2-9-5/h1-2H,8H2.
What are the key properties of 2-chloro-5-fluoropyridin-3-amine?
2-chloro-5-fluoropyridin-3-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 2-chloro-5-fluoropyridin-3-amine is sourced from PubChem (CID 44754868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).