2-[1-(3-fluoro-2-pyridinyl)imidazol-2-yl]ethanamine

C10H11FN4 — CID 62733441

IUPAC2-[1-(3-fluoro-2-pyridinyl)imidazol-2-yl]ethanamine
SMILESNCCc1nccn1-c1ncccc1F
InChIInChI=1S/C10H11FN4/c11-8-2-1-5-14-10(8)15-7-6-13-9(15)3-4-12/h1-2,5-7H,3-4,12H2
InChIKeyHUFWAEAIVHOEDK-UHFFFAOYSA-N
MW206.22 g/mol
LogP0.91
Rot. Bonds3

About 2-[1-(3-fluoro-2-pyridinyl)imidazol-2-yl]ethanamine

2-[1-(3-fluoro-2-pyridinyl)imidazol-2-yl]ethanamine (PubChem CID 62733441) has the molecular formula C10H11FN4 and a molecular weight of 206.22 g/mol. Its IUPAC name is 2-[1-(3-fluoro-2-pyridinyl)imidazol-2-yl]ethanamine.

Molecular Properties

Compound Name2-[1-(3-fluoro-2-pyridinyl)imidazol-2-yl]ethanamine
PubChem CID62733441
Molecular FormulaC10H11FN4
Molecular Weight206.22 g/mol
Exact Mass206.10
IUPAC Name2-[1-(3-fluoro-2-pyridinyl)imidazol-2-yl]ethanamine
SMILESNCCc1nccn1-c1ncccc1F
InChIInChI=1S/C10H11FN4/c11-8-2-1-5-14-10(8)15-7-6-13-9(15)3-4-12/h1-2,5-7H,3-4,12H2
InChIKeyHUFWAEAIVHOEDK-UHFFFAOYSA-N
XLogP0.91
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(3-fluoro-2-pyridinyl)imidazol-2-yl]ethanamine?
The IUPAC name of 2-[1-(3-fluoro-2-pyridinyl)imidazol-2-yl]ethanamine (CID 62733441) is 2-[1-(3-fluoro-2-pyridinyl)imidazol-2-yl]ethanamine.
What is the SMILES notation for 2-[1-(3-fluoro-2-pyridinyl)imidazol-2-yl]ethanamine?
The canonical SMILES for 2-[1-(3-fluoro-2-pyridinyl)imidazol-2-yl]ethanamine is NCCc1nccn1-c1ncccc1F.
What is the InChIKey of 2-[1-(3-fluoro-2-pyridinyl)imidazol-2-yl]ethanamine?
The InChIKey is HUFWAEAIVHOEDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN4/c11-8-2-1-5-14-10(8)15-7-6-13-9(15)3-4-12/h1-2,5-7H,3-4,12H2.
What are the key properties of 2-[1-(3-fluoro-2-pyridinyl)imidazol-2-yl]ethanamine?
2-[1-(3-fluoro-2-pyridinyl)imidazol-2-yl]ethanamine has a molecular weight of 206.22 g/mol, XLogP of 0.91, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(3-fluoro-2-pyridinyl)imidazol-2-yl]ethanamine is sourced from PubChem (CID 62733441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).