2-[1-(5-fluoro-2-pyridinyl)pyrazol-3-yl]ethanamine

C10H11FN4 — CID 86713077

IUPAC2-[1-(5-fluoro-2-pyridinyl)pyrazol-3-yl]ethanamine
SMILESNCCc1ccn(-c2ccc(F)cn2)n1
InChIInChI=1S/C10H11FN4/c11-8-1-2-10(13-7-8)15-6-4-9(14-15)3-5-12/h1-2,4,6-7H,3,5,12H2
InChIKeyRQPUFJJWRNDJCE-UHFFFAOYSA-N
MW206.22 g/mol
LogP0.91
Rot. Bonds3

About 2-[1-(5-fluoro-2-pyridinyl)pyrazol-3-yl]ethanamine

2-[1-(5-fluoro-2-pyridinyl)pyrazol-3-yl]ethanamine (PubChem CID 86713077) has the molecular formula C10H11FN4 and a molecular weight of 206.22 g/mol. Its IUPAC name is 2-[1-(5-fluoro-2-pyridinyl)pyrazol-3-yl]ethanamine.

Molecular Properties

Compound Name2-[1-(5-fluoro-2-pyridinyl)pyrazol-3-yl]ethanamine
PubChem CID86713077
Molecular FormulaC10H11FN4
Molecular Weight206.22 g/mol
Exact Mass206.10
IUPAC Name2-[1-(5-fluoro-2-pyridinyl)pyrazol-3-yl]ethanamine
SMILESNCCc1ccn(-c2ccc(F)cn2)n1
InChIInChI=1S/C10H11FN4/c11-8-1-2-10(13-7-8)15-6-4-9(14-15)3-5-12/h1-2,4,6-7H,3,5,12H2
InChIKeyRQPUFJJWRNDJCE-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-(5-fluoro-2-pyridinyl)pyrazol-3-yl]ethanamine?
The IUPAC name of 2-[1-(5-fluoro-2-pyridinyl)pyrazol-3-yl]ethanamine (CID 86713077) is 2-[1-(5-fluoro-2-pyridinyl)pyrazol-3-yl]ethanamine.
What is the SMILES notation for 2-[1-(5-fluoro-2-pyridinyl)pyrazol-3-yl]ethanamine?
The canonical SMILES for 2-[1-(5-fluoro-2-pyridinyl)pyrazol-3-yl]ethanamine is NCCc1ccn(-c2ccc(F)cn2)n1.
What is the InChIKey of 2-[1-(5-fluoro-2-pyridinyl)pyrazol-3-yl]ethanamine?
The InChIKey is RQPUFJJWRNDJCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN4/c11-8-1-2-10(13-7-8)15-6-4-9(14-15)3-5-12/h1-2,4,6-7H,3,5,12H2.
What are the key properties of 2-[1-(5-fluoro-2-pyridinyl)pyrazol-3-yl]ethanamine?
2-[1-(5-fluoro-2-pyridinyl)pyrazol-3-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-(5-fluoro-2-pyridinyl)pyrazol-3-yl]ethanamine is sourced from PubChem (CID 86713077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).