2-[1-(2-fluoroethyl)-3-pyridin-2-ylpyrazol-5-yl]ethanamine

C12H15FN4 — CID 121210777

IUPAC2-[1-(2-fluoroethyl)-3-pyridin-2-ylpyrazol-5-yl]ethanamine
SMILESNCCc1cc(-c2ccccn2)nn1CCF
InChIInChI=1S/C12H15FN4/c13-5-8-17-10(4-6-14)9-12(16-17)11-3-1-2-7-15-11/h1-3,7,9H,4-6,8,14H2
InChIKeyLYSQZIYJWOLSFZ-UHFFFAOYSA-N
MW234.28 g/mol
LogP1.42
Rot. Bonds5

About 2-[1-(2-fluoroethyl)-3-pyridin-2-ylpyrazol-5-yl]ethanamine

2-[1-(2-fluoroethyl)-3-pyridin-2-ylpyrazol-5-yl]ethanamine (PubChem CID 121210777) has the molecular formula C12H15FN4 and a molecular weight of 234.28 g/mol. Its IUPAC name is 2-[1-(2-fluoroethyl)-3-pyridin-2-ylpyrazol-5-yl]ethanamine.

Molecular Properties

Compound Name2-[1-(2-fluoroethyl)-3-pyridin-2-ylpyrazol-5-yl]ethanamine
PubChem CID121210777
Molecular FormulaC12H15FN4
Molecular Weight234.28 g/mol
Exact Mass234.13
IUPAC Name2-[1-(2-fluoroethyl)-3-pyridin-2-ylpyrazol-5-yl]ethanamine
SMILESNCCc1cc(-c2ccccn2)nn1CCF
InChIInChI=1S/C12H15FN4/c13-5-8-17-10(4-6-14)9-12(16-17)11-3-1-2-7-15-11/h1-3,7,9H,4-6,8,14H2
InChIKeyLYSQZIYJWOLSFZ-UHFFFAOYSA-N
XLogP1.42
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Pyrazolo(1,5-a)pyridine
CID 67507
3-(1H-pyrazol-5-yl)pyridine
CID 7074967
2-(1h-[1,2,3]Triazol-4-yl)pyridine
CID 9812807
2-methyl-6-(1H-1,2,3-triazol-5-yl)pyridine
CID 9964176
(3-(pyridin-3-yl)-1H-pyrazol-5-yl)methanamine
CID 11993870
1-{4-[3-(4-Fluorophenyl)-1-Methyl-1h-Pyrazol-4-Yl]pyridin-2-Yl}-N-Methylmethanamine
CID 71710904
(1S,3R)-N-((1-ethyl-5-(5-fluoro-6-methylpyridin-3-yl)-4-methyl-1H-pyrazol-3-yl)methyl)-3-fluorocyclopentanamine
CID 45270907
(1S,3R)-3-fluoro-N-((5-(5-fluoro-6-methylpyridin-3-yl)-1-isopropyl-4-methyl-1H-pyrazol-3-yl)methyl)cyclopentanamine
CID 45273531
2-(Pyrrolidin-2-yl)pyridine
CID 2771659
2-methyl-5-(1H-pyrazol-5-yl)pyridine
CID 2805912
5-(Pyridine-4-Yl)-3-(Trifluoromethyl)Pyrazole
CID 2822970
3-(Pyridine-2-yl)-5-trifluoromethylpyrazole
CID 611600

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-fluoroethyl)-3-pyridin-2-ylpyrazol-5-yl]ethanamine?
The IUPAC name of 2-[1-(2-fluoroethyl)-3-pyridin-2-ylpyrazol-5-yl]ethanamine (CID 121210777) is 2-[1-(2-fluoroethyl)-3-pyridin-2-ylpyrazol-5-yl]ethanamine.
What is the SMILES notation for 2-[1-(2-fluoroethyl)-3-pyridin-2-ylpyrazol-5-yl]ethanamine?
The canonical SMILES for 2-[1-(2-fluoroethyl)-3-pyridin-2-ylpyrazol-5-yl]ethanamine is NCCc1cc(-c2ccccn2)nn1CCF.
What is the InChIKey of 2-[1-(2-fluoroethyl)-3-pyridin-2-ylpyrazol-5-yl]ethanamine?
The InChIKey is LYSQZIYJWOLSFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN4/c13-5-8-17-10(4-6-14)9-12(16-17)11-3-1-2-7-15-11/h1-3,7,9H,4-6,8,14H2.
What are the key properties of 2-[1-(2-fluoroethyl)-3-pyridin-2-ylpyrazol-5-yl]ethanamine?
2-[1-(2-fluoroethyl)-3-pyridin-2-ylpyrazol-5-yl]ethanamine has a molecular weight of 234.28 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-fluoroethyl)-3-pyridin-2-ylpyrazol-5-yl]ethanamine is sourced from PubChem (CID 121210777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).