ethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate

C10H8BrClN2O2 — CID 169163079

IUPACethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1cnn2cc(Br)c(Cl)cc12
InChIInChI=1S/C10H8BrClN2O2/c1-2-16-10(15)6-4-13-14-5-7(11)8(12)3-9(6)14/h3-5H,2H2,1H3
InChIKeyJMJTWJMLCLDHDA-UHFFFAOYSA-N
MW303.54 g/mol
LogP2.93
Rot. Bonds2

About ethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate

ethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate (PubChem CID 169163079) has the molecular formula C10H8BrClN2O2 and a molecular weight of 303.54 g/mol. Its IUPAC name is ethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate
PubChem CID169163079
Molecular FormulaC10H8BrClN2O2
Molecular Weight303.54 g/mol
Exact Mass301.95
IUPAC Nameethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1cnn2cc(Br)c(Cl)cc12
InChIInChI=1S/C10H8BrClN2O2/c1-2-16-10(15)6-4-13-14-5-7(11)8(12)3-9(6)14/h3-5H,2H2,1H3
InChIKeyJMJTWJMLCLDHDA-UHFFFAOYSA-N
XLogP2.93
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.54
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 5-(hydroxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate
CID 71464261
ethyl 6-bromopyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 45073325
ethyl 5-[(2-chlorobenzoyl)amino]pyrazolo[1,5-a]pyridine-3-carboxylate
CID 71797786
ethyl 6-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylate
CID 131697608
ethyl 5-bromo-4-chloro-2-hydroxybenzoate
CID 19701624
ethyl 5-[(2-bromobenzoyl)amino]pyrazolo[1,5-a]pyridine-3-carboxylate
CID 71797787
ethyl 8-chloro-2-methylimidazo[1,2-b]pyridazine-7-carboxylate
CID 162494367
2-(3-ethoxycarbonylpyrazolo[1,5-a]pyridin-6-yl)oxyacetic acid
CID 118661383
ethyl 6-[(2R)-2-aminopropoxy]-5-chloropyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 155425580
ethyl 5-[(2-chloroacetyl)amino]pyrazolo[1,5-a]pyridine-3-carboxylate
CID 90556540
ethyl 5-[[2-(2-chlorophenyl)acetyl]amino]pyrazolo[1,5-a]pyridine-3-carboxylate
CID 71797808
diethyl 4,5-dichlorobenzene-1,2-dicarboxylate
CID 10517655

Frequently Asked Questions

What is the IUPAC name of ethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate?
The IUPAC name of ethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate (CID 169163079) is ethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate.
What is the SMILES notation for ethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate?
The canonical SMILES for ethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate is CCOC(=O)c1cnn2cc(Br)c(Cl)cc12.
What is the InChIKey of ethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate?
The InChIKey is JMJTWJMLCLDHDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrClN2O2/c1-2-16-10(15)6-4-13-14-5-7(11)8(12)3-9(6)14/h3-5H,2H2,1H3.
What are the key properties of ethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate?
ethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate has a molecular weight of 303.54 g/mol, XLogP of 2.93, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate is sourced from PubChem (CID 169163079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).