methyl 5-aminopyrazolo[1,5-a]pyridine-3-carboxylate

C9H9N3O2 — CID 117273567

IUPACmethyl 5-aminopyrazolo[1,5-a]pyridine-3-carboxylate
SMILESCOC(=O)c1cnn2ccc(N)cc12
InChIInChI=1S/C9H9N3O2/c1-14-9(13)7-5-11-12-3-2-6(10)4-8(7)12/h2-5H,10H2,1H3
InChIKeyLTRSMQJKXTXEOK-UHFFFAOYSA-N
MW191.19 g/mol
LogP0.70
Rot. Bonds1

About methyl 5-aminopyrazolo[1,5-a]pyridine-3-carboxylate

methyl 5-aminopyrazolo[1,5-a]pyridine-3-carboxylate (PubChem CID 117273567) has the molecular formula C9H9N3O2 and a molecular weight of 191.19 g/mol. Its IUPAC name is methyl 5-aminopyrazolo[1,5-a]pyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 5-aminopyrazolo[1,5-a]pyridine-3-carboxylate
PubChem CID117273567
Molecular FormulaC9H9N3O2
Molecular Weight191.19 g/mol
Exact Mass191.07
IUPAC Namemethyl 5-aminopyrazolo[1,5-a]pyridine-3-carboxylate
SMILESCOC(=O)c1cnn2ccc(N)cc12
InChIInChI=1S/C9H9N3O2/c1-14-9(13)7-5-11-12-3-2-6(10)4-8(7)12/h2-5H,10H2,1H3
InChIKeyLTRSMQJKXTXEOK-UHFFFAOYSA-N
XLogP0.70
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of methyl 5-aminopyrazolo[1,5-a]pyridine-3-carboxylate?
The IUPAC name of methyl 5-aminopyrazolo[1,5-a]pyridine-3-carboxylate (CID 117273567) is methyl 5-aminopyrazolo[1,5-a]pyridine-3-carboxylate.
What is the SMILES notation for methyl 5-aminopyrazolo[1,5-a]pyridine-3-carboxylate?
The canonical SMILES for methyl 5-aminopyrazolo[1,5-a]pyridine-3-carboxylate is COC(=O)c1cnn2ccc(N)cc12.
What is the InChIKey of methyl 5-aminopyrazolo[1,5-a]pyridine-3-carboxylate?
The InChIKey is LTRSMQJKXTXEOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O2/c1-14-9(13)7-5-11-12-3-2-6(10)4-8(7)12/h2-5H,10H2,1H3.
What are the key properties of methyl 5-aminopyrazolo[1,5-a]pyridine-3-carboxylate?
methyl 5-aminopyrazolo[1,5-a]pyridine-3-carboxylate has a molecular weight of 191.19 g/mol, XLogP of 0.70, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-aminopyrazolo[1,5-a]pyridine-3-carboxylate is sourced from PubChem (CID 117273567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).