5-fluoro-1-(1-methylpyrazol-3-yl)-2H-pyridine

C9H10FN3 — CID 141425886

IUPAC5-fluoro-1-(1-methylpyrazol-3-yl)-2H-pyridine
SMILESCn1ccc(N2C=C(F)C=CC2)n1
InChIInChI=1S/C9H10FN3/c1-12-6-4-9(11-12)13-5-2-3-8(10)7-13/h2-4,6-7H,5H2,1H3
InChIKeyIUFQVTOYXCLPJY-UHFFFAOYSA-N
MW179.20 g/mol
LogP1.61
Rot. Bonds1

About 5-fluoro-1-(1-methylpyrazol-3-yl)-2H-pyridine

5-fluoro-1-(1-methylpyrazol-3-yl)-2H-pyridine (PubChem CID 141425886) has the molecular formula C9H10FN3 and a molecular weight of 179.20 g/mol. Its IUPAC name is 5-fluoro-1-(1-methylpyrazol-3-yl)-2H-pyridine.

Molecular Properties

Compound Name5-fluoro-1-(1-methylpyrazol-3-yl)-2H-pyridine
PubChem CID141425886
Molecular FormulaC9H10FN3
Molecular Weight179.20 g/mol
Exact Mass179.09
IUPAC Name5-fluoro-1-(1-methylpyrazol-3-yl)-2H-pyridine
SMILESCn1ccc(N2C=C(F)C=CC2)n1
InChIInChI=1S/C9H10FN3/c1-12-6-4-9(11-12)13-5-2-3-8(10)7-13/h2-4,6-7H,5H2,1H3
InChIKeyIUFQVTOYXCLPJY-UHFFFAOYSA-N
XLogP1.61
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.20
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-methyl-1H-pyrazol-3-amine
CID 60809330
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CID 126810988
1-methyl-N-(2,2,2-trifluoroethyl)pyrazol-3-amine
CID 79778362
1-methyl-N-(3,3,3-trifluoropropyl)pyrazol-3-amine
CID 79778959
1-(2-Ethenyl-3-fluoro-4-methylidenehex-2-enyl)-3-thionitrosopyrazole
CID 90753693
4-(trifluoromethyl)-7H-pyrazolo[1,5-a]pyrimidine
CID 91311047
5-(3-Fluoropyrrolidin-1-yl)-1-methylpyrazole
CID 141313418
3,3-Difluoro-1-(2-methylpyrazol-3-yl)piperidine
CID 141313424
4,4-Difluoro-1-(2-methylpyrazol-3-yl)piperidine
CID 141377693
5-(3,3-Difluoropyrrolidin-1-yl)-1-methylpyrazole
CID 141420768
N-tert-butyl-1-(2-fluoroethyl)pyrazol-3-amine
CID 141673159

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-(1-methylpyrazol-3-yl)-2H-pyridine?
The IUPAC name of 5-fluoro-1-(1-methylpyrazol-3-yl)-2H-pyridine (CID 141425886) is 5-fluoro-1-(1-methylpyrazol-3-yl)-2H-pyridine.
What is the SMILES notation for 5-fluoro-1-(1-methylpyrazol-3-yl)-2H-pyridine?
The canonical SMILES for 5-fluoro-1-(1-methylpyrazol-3-yl)-2H-pyridine is Cn1ccc(N2C=C(F)C=CC2)n1.
What is the InChIKey of 5-fluoro-1-(1-methylpyrazol-3-yl)-2H-pyridine?
The InChIKey is IUFQVTOYXCLPJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN3/c1-12-6-4-9(11-12)13-5-2-3-8(10)7-13/h2-4,6-7H,5H2,1H3.
What are the key properties of 5-fluoro-1-(1-methylpyrazol-3-yl)-2H-pyridine?
5-fluoro-1-(1-methylpyrazol-3-yl)-2H-pyridine has a molecular weight of 179.20 g/mol, XLogP of 1.61, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1-(1-methylpyrazol-3-yl)-2H-pyridine is sourced from PubChem (CID 141425886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).