N-ethyl-6-(3-fluoro-4-pyridinyl)pyridazin-3-amine

C11H11FN4 — CID 104739269

IUPACN-ethyl-6-(3-fluoro-4-pyridinyl)pyridazin-3-amine
SMILESCCNc1ccc(-c2ccncc2F)nn1
InChIInChI=1S/C11H11FN4/c1-2-14-11-4-3-10(15-16-11)8-5-6-13-7-9(8)12/h3-7H,2H2,1H3,(H,14,16)
InChIKeyLZDCKVFJIHUXKO-UHFFFAOYSA-N
MW218.24 g/mol
LogP2.11
Rot. Bonds3

About N-ethyl-6-(3-fluoro-4-pyridinyl)pyridazin-3-amine

N-ethyl-6-(3-fluoro-4-pyridinyl)pyridazin-3-amine (PubChem CID 104739269) has the molecular formula C11H11FN4 and a molecular weight of 218.24 g/mol. Its IUPAC name is N-ethyl-6-(3-fluoro-4-pyridinyl)pyridazin-3-amine.

Molecular Properties

Compound NameN-ethyl-6-(3-fluoro-4-pyridinyl)pyridazin-3-amine
PubChem CID104739269
Molecular FormulaC11H11FN4
Molecular Weight218.24 g/mol
Exact Mass218.10
IUPAC NameN-ethyl-6-(3-fluoro-4-pyridinyl)pyridazin-3-amine
SMILESCCNc1ccc(-c2ccncc2F)nn1
InChIInChI=1S/C11H11FN4/c1-2-14-11-4-3-10(15-16-11)8-5-6-13-7-9(8)12/h3-7H,2H2,1H3,(H,14,16)
InChIKeyLZDCKVFJIHUXKO-UHFFFAOYSA-N
XLogP2.11
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.24
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-(3-fluoro-4-pyridinyl)pyridazin-3-amine?
The IUPAC name of N-ethyl-6-(3-fluoro-4-pyridinyl)pyridazin-3-amine (CID 104739269) is N-ethyl-6-(3-fluoro-4-pyridinyl)pyridazin-3-amine.
What is the SMILES notation for N-ethyl-6-(3-fluoro-4-pyridinyl)pyridazin-3-amine?
The canonical SMILES for N-ethyl-6-(3-fluoro-4-pyridinyl)pyridazin-3-amine is CCNc1ccc(-c2ccncc2F)nn1.
What is the InChIKey of N-ethyl-6-(3-fluoro-4-pyridinyl)pyridazin-3-amine?
The InChIKey is LZDCKVFJIHUXKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN4/c1-2-14-11-4-3-10(15-16-11)8-5-6-13-7-9(8)12/h3-7H,2H2,1H3,(H,14,16).
What are the key properties of N-ethyl-6-(3-fluoro-4-pyridinyl)pyridazin-3-amine?
N-ethyl-6-(3-fluoro-4-pyridinyl)pyridazin-3-amine has a molecular weight of 218.24 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-(3-fluoro-4-pyridinyl)pyridazin-3-amine is sourced from PubChem (CID 104739269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).