ethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate

C10H12N4O2 — CID 1089239

IUPACethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate
SMILESCCOC(=O)c1cnc2cc(C)nn2c1N
InChIInChI=1S/C10H12N4O2/c1-3-16-10(15)7-5-12-8-4-6(2)13-14(8)9(7)11/h4-5H,3,11H2,1-2H3
InChIKeyUQUFOQMTNQTGIS-UHFFFAOYSA-N
MW220.23 g/mol
LogP0.80
Rot. Bonds2

About ethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate

ethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate (PubChem CID 1089239) has the molecular formula C10H12N4O2 and a molecular weight of 220.23 g/mol. Its IUPAC name is ethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate.

Molecular Properties

Compound Nameethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate
PubChem CID1089239
Molecular FormulaC10H12N4O2
Molecular Weight220.23 g/mol
Exact Mass220.10
IUPAC Nameethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate
SMILESCCOC(=O)c1cnc2cc(C)nn2c1N
InChIInChI=1S/C10H12N4O2/c1-3-16-10(15)7-5-12-8-4-6(2)13-14(8)9(7)11/h4-5H,3,11H2,1-2H3
InChIKeyUQUFOQMTNQTGIS-UHFFFAOYSA-N
XLogP0.80
TPSA82.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of ethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate?
The IUPAC name of ethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate (CID 1089239) is ethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate.
What is the SMILES notation for ethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate?
The canonical SMILES for ethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate is CCOC(=O)c1cnc2cc(C)nn2c1N.
What is the InChIKey of ethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate?
The InChIKey is UQUFOQMTNQTGIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2/c1-3-16-10(15)7-5-12-8-4-6(2)13-14(8)9(7)11/h4-5H,3,11H2,1-2H3.
What are the key properties of ethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate?
ethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate has a molecular weight of 220.23 g/mol, XLogP of 0.80, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate is sourced from PubChem (CID 1089239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).