7-chloro-1-ethylpyrazolo[4,3-b]pyridine

C8H8ClN3 — CID 84718585

IUPAC7-chloro-1-ethylpyrazolo[4,3-b]pyridine
SMILESCCn1ncc2nccc(Cl)c21
InChIInChI=1S/C8H8ClN3/c1-2-12-8-6(9)3-4-10-7(8)5-11-12/h3-5H,2H2,1H3
InChIKeyDFYXFLPFTYCNPZ-UHFFFAOYSA-N
MW181.63 g/mol
LogP2.10
Rot. Bonds1

About 7-chloro-1-ethylpyrazolo[4,3-b]pyridine

7-chloro-1-ethylpyrazolo[4,3-b]pyridine (PubChem CID 84718585) has the molecular formula C8H8ClN3 and a molecular weight of 181.63 g/mol. Its IUPAC name is 7-chloro-1-ethylpyrazolo[4,3-b]pyridine.

Molecular Properties

Compound Name7-chloro-1-ethylpyrazolo[4,3-b]pyridine
PubChem CID84718585
Molecular FormulaC8H8ClN3
Molecular Weight181.63 g/mol
Exact Mass181.04
IUPAC Name7-chloro-1-ethylpyrazolo[4,3-b]pyridine
SMILESCCn1ncc2nccc(Cl)c21
InChIInChI=1S/C8H8ClN3/c1-2-12-8-6(9)3-4-10-7(8)5-11-12/h3-5H,2H2,1H3
InChIKeyDFYXFLPFTYCNPZ-UHFFFAOYSA-N
XLogP2.10
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.63
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-iodo-1-propylpyrazolo[4,3-b]pyridine
CID 67470502
ethane;1-ethylpyrazolo[4,5-b]pyridine
CID 164593450
4-chloro-1-ethyl-5-fluoropyrazole
CID 105429239
4-chloro-1-ethylpyrazolo[3,4-b]pyridine;N-propylformamide
CID 87653399
N-[(4-chloro-1-ethylpyrazol-5-yl)-(2-methyl-4-pyridinyl)methyl]ethanamine
CID 106755859
5-(2-chloroethyl)-1-ethylpyrazole
CID 63974716
1-(4-chloro-1-ethylpyrazol-5-yl)-4-methylpentan-1-amine
CID 114648699
3-[(4-chloro-1-ethylpyrazol-5-yl)methyl]pyridin-2-amine
CID 114663382
4-(2-chlorophenyl)-1-ethyl-5-methylpyrazole
CID 162636745
ethane;1-ethyl-4-methylpyrazolo[3,4-b]pyridine
CID 162761081
1-(4-chloro-1-ethylpyrazol-5-yl)-N,2,3-trimethylbutan-1-amine
CID 105040619
5-(2-chloro-3-methoxyphenyl)-1-ethyl-7-methylpyrazolo[4,5-b]pyridine
CID 171913716

Frequently Asked Questions

What is the IUPAC name of 7-chloro-1-ethylpyrazolo[4,3-b]pyridine?
The IUPAC name of 7-chloro-1-ethylpyrazolo[4,3-b]pyridine (CID 84718585) is 7-chloro-1-ethylpyrazolo[4,3-b]pyridine.
What is the SMILES notation for 7-chloro-1-ethylpyrazolo[4,3-b]pyridine?
The canonical SMILES for 7-chloro-1-ethylpyrazolo[4,3-b]pyridine is CCn1ncc2nccc(Cl)c21.
What is the InChIKey of 7-chloro-1-ethylpyrazolo[4,3-b]pyridine?
The InChIKey is DFYXFLPFTYCNPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClN3/c1-2-12-8-6(9)3-4-10-7(8)5-11-12/h3-5H,2H2,1H3.
What are the key properties of 7-chloro-1-ethylpyrazolo[4,3-b]pyridine?
7-chloro-1-ethylpyrazolo[4,3-b]pyridine has a molecular weight of 181.63 g/mol, XLogP of 2.10, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-1-ethylpyrazolo[4,3-b]pyridine is sourced from PubChem (CID 84718585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).