2-(3-bromo-5-ethylpyrazol-1-yl)-3-chloropyridine

C10H9BrClN3 — CID 143762317

IUPAC2-(3-bromo-5-ethylpyrazol-1-yl)-3-chloropyridine
SMILESCCc1cc(Br)nn1-c1ncccc1Cl
InChIInChI=1S/C10H9BrClN3/c1-2-7-6-9(11)14-15(7)10-8(12)4-3-5-13-10/h3-6H,2H2,1H3
InChIKeyZQEAAYODTXEJNB-UHFFFAOYSA-N
MW286.56 g/mol
LogP3.25
Rot. Bonds2

About 2-(3-bromo-5-ethylpyrazol-1-yl)-3-chloropyridine

2-(3-bromo-5-ethylpyrazol-1-yl)-3-chloropyridine (PubChem CID 143762317) has the molecular formula C10H9BrClN3 and a molecular weight of 286.56 g/mol. Its IUPAC name is 2-(3-bromo-5-ethylpyrazol-1-yl)-3-chloropyridine.

Molecular Properties

Compound Name2-(3-bromo-5-ethylpyrazol-1-yl)-3-chloropyridine
PubChem CID143762317
Molecular FormulaC10H9BrClN3
Molecular Weight286.56 g/mol
Exact Mass284.97
IUPAC Name2-(3-bromo-5-ethylpyrazol-1-yl)-3-chloropyridine
SMILESCCc1cc(Br)nn1-c1ncccc1Cl
InChIInChI=1S/C10H9BrClN3/c1-2-7-6-9(11)14-15(7)10-8(12)4-3-5-13-10/h3-6H,2H2,1H3
InChIKeyZQEAAYODTXEJNB-UHFFFAOYSA-N
XLogP3.25
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.56
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-bromo-1-(3-chloro-2-pyridinyl)pyrazol-5-yl]-N-methylmethanamine
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2-(3-bromo-5-methylsulfanylpyrazol-1-yl)-3-chloropyridine
CID 155042082
ethyl (Z)-3-[3-bromo-1-(3-chloro-2-pyridinyl)pyrazol-5-yl]-2-chloroprop-2-enoate
CID 175484507
2-(3-bromopyrazol-1-yl)-3-chloropyridine
CID 174603551
2-[3-bromo-1-(3-chloro-2-pyridinyl)pyrazol-5-yl]-8-ethyl-3,1-benzoxazin-4-one
CID 66854279
2-[[3-bromo-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl]-ethylamino]-3,5-dichlorobenzoyl chloride
CID 175539000
[3-bromo-1-(3-chloro-2-pyridinyl)pyrazol-5-yl]-imidazol-1-ylmethanone
CID 123646569
3,5-dibromo-2-[[3-bromo-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl]-ethylamino]benzoyl chloride
CID 175538981
3-bromo-2-[[3-bromo-1-(3-chloro-2-pyridinyl)pyrazole-5-carbonyl]-ethylamino]-5-chlorobenzoyl chloride
CID 175539002
3-bromo-1-(3-chloro-2-pyridinyl)-N-[2,4-dichloro-6-(methylcarbamoyl)phenyl]-N-ethylpyrazole-5-carboxamide
CID 155666892
ethyl 3-bromo-1-(3-chloro-2-pyridinyl)-5-methylpyrazole-4-carboxylate
CID 155213094
3-bromo-N-(4-chloro-2-methylphenyl)-1-(3-chloro-2-pyridinyl)pyrazole-5-carboxamide
CID 141285430

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromo-5-ethylpyrazol-1-yl)-3-chloropyridine?
The IUPAC name of 2-(3-bromo-5-ethylpyrazol-1-yl)-3-chloropyridine (CID 143762317) is 2-(3-bromo-5-ethylpyrazol-1-yl)-3-chloropyridine.
What is the SMILES notation for 2-(3-bromo-5-ethylpyrazol-1-yl)-3-chloropyridine?
The canonical SMILES for 2-(3-bromo-5-ethylpyrazol-1-yl)-3-chloropyridine is CCc1cc(Br)nn1-c1ncccc1Cl.
What is the InChIKey of 2-(3-bromo-5-ethylpyrazol-1-yl)-3-chloropyridine?
The InChIKey is ZQEAAYODTXEJNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrClN3/c1-2-7-6-9(11)14-15(7)10-8(12)4-3-5-13-10/h3-6H,2H2,1H3.
What are the key properties of 2-(3-bromo-5-ethylpyrazol-1-yl)-3-chloropyridine?
2-(3-bromo-5-ethylpyrazol-1-yl)-3-chloropyridine has a molecular weight of 286.56 g/mol, XLogP of 3.25, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromo-5-ethylpyrazol-1-yl)-3-chloropyridine is sourced from PubChem (CID 143762317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).