5-(6-fluoropyridazin-3-yl)pyrrolidin-3-amine

C8H11FN4 — CID 129188399

IUPAC5-(6-fluoropyridazin-3-yl)pyrrolidin-3-amine
SMILESNC1CNC(c2ccc(F)nn2)C1
InChIInChI=1S/C8H11FN4/c9-8-2-1-6(12-13-8)7-3-5(10)4-11-7/h1-2,5,7,11H,3-4,10H2
InChIKeyONQHGSWBRFESIV-UHFFFAOYSA-N
MW182.20 g/mol
LogP-0.02
Rot. Bonds1

About 5-(6-fluoropyridazin-3-yl)pyrrolidin-3-amine

5-(6-fluoropyridazin-3-yl)pyrrolidin-3-amine (PubChem CID 129188399) has the molecular formula C8H11FN4 and a molecular weight of 182.20 g/mol. Its IUPAC name is 5-(6-fluoropyridazin-3-yl)pyrrolidin-3-amine.

Molecular Properties

Compound Name5-(6-fluoropyridazin-3-yl)pyrrolidin-3-amine
PubChem CID129188399
Molecular FormulaC8H11FN4
Molecular Weight182.20 g/mol
Exact Mass182.10
IUPAC Name5-(6-fluoropyridazin-3-yl)pyrrolidin-3-amine
SMILESNC1CNC(c2ccc(F)nn2)C1
InChIInChI=1S/C8H11FN4/c9-8-2-1-6(12-13-8)7-3-5(10)4-11-7/h1-2,5,7,11H,3-4,10H2
InChIKeyONQHGSWBRFESIV-UHFFFAOYSA-N
XLogP-0.02
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.20
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(6-fluoropyridazin-3-yl)pyrrolidin-3-amine?
The IUPAC name of 5-(6-fluoropyridazin-3-yl)pyrrolidin-3-amine (CID 129188399) is 5-(6-fluoropyridazin-3-yl)pyrrolidin-3-amine.
What is the SMILES notation for 5-(6-fluoropyridazin-3-yl)pyrrolidin-3-amine?
The canonical SMILES for 5-(6-fluoropyridazin-3-yl)pyrrolidin-3-amine is NC1CNC(c2ccc(F)nn2)C1.
What is the InChIKey of 5-(6-fluoropyridazin-3-yl)pyrrolidin-3-amine?
The InChIKey is ONQHGSWBRFESIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN4/c9-8-2-1-6(12-13-8)7-3-5(10)4-11-7/h1-2,5,7,11H,3-4,10H2.
What are the key properties of 5-(6-fluoropyridazin-3-yl)pyrrolidin-3-amine?
5-(6-fluoropyridazin-3-yl)pyrrolidin-3-amine has a molecular weight of 182.20 g/mol, XLogP of -0.02, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-fluoropyridazin-3-yl)pyrrolidin-3-amine is sourced from PubChem (CID 129188399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).