ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate

C10H10BrN3O2 — CID 146160563

IUPACethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1cnn2ccc(N)c(Br)c12
InChIInChI=1S/C10H10BrN3O2/c1-2-16-10(15)6-5-13-14-4-3-7(12)8(11)9(6)14/h3-5H,2,12H2,1H3
InChIKeyODZZSWBMUJWOER-UHFFFAOYSA-N
MW284.11 g/mol
LogP1.86
Rot. Bonds2

About ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate

ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate (PubChem CID 146160563) has the molecular formula C10H10BrN3O2 and a molecular weight of 284.11 g/mol. Its IUPAC name is ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate
PubChem CID146160563
Molecular FormulaC10H10BrN3O2
Molecular Weight284.11 g/mol
Exact Mass283.00
IUPAC Nameethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1cnn2ccc(N)c(Br)c12
InChIInChI=1S/C10H10BrN3O2/c1-2-16-10(15)6-5-13-14-4-3-7(12)8(11)9(6)14/h3-5H,2,12H2,1H3
InChIKeyODZZSWBMUJWOER-UHFFFAOYSA-N
XLogP1.86
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.11
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 6-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylate
CID 131697608
ethyl 4-amino-3-bromo-2-chlorobenzoate
CID 171016631
acetylene;ethyl 5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 142589568
ethyl 5-(4-methylpiperazin-1-yl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 122672896
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-bromo-1-(4-bromophenyl)pyrazole-4-carboxylate
CID 53429357
ethyl 5-(2-amino-4,6-dimethylpyrimidin-5-yl)pyrazolo[1,5-a]pyridine-3-carboxylate
CID 176643568
ethyl 4-amino-2-bromo-3-methylbenzoate
CID 171020944
ethyl propanoate;ethyl pyrazolo[1,5-a]pyridine-3-carboxylate
CID 161412024
ethyl 6-bromo-5-chloropyrazolo[1,5-a]pyridine-3-carboxylate
CID 169163079
ethyl 5-[(2-bromobenzoyl)amino]pyrazolo[1,5-a]pyridine-3-carboxylate
CID 71797787

Frequently Asked Questions

What is the IUPAC name of ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate?
The IUPAC name of ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate (CID 146160563) is ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate.
What is the SMILES notation for ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate?
The canonical SMILES for ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate is CCOC(=O)c1cnn2ccc(N)c(Br)c12.
What is the InChIKey of ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate?
The InChIKey is ODZZSWBMUJWOER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN3O2/c1-2-16-10(15)6-5-13-14-4-3-7(12)8(11)9(6)14/h3-5H,2,12H2,1H3.
What are the key properties of ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate?
ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate has a molecular weight of 284.11 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 5-amino-4-bromopyrazolo[1,5-a]pyridine-3-carboxylate is sourced from PubChem (CID 146160563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).