ethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate

C11H14N4O2 — CID 155346646

IUPACethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate
SMILESCCOC(=O)c1cc2c(NC)nc(C)cn2n1
InChIInChI=1S/C11H14N4O2/c1-4-17-11(16)8-5-9-10(12-3)13-7(2)6-15(9)14-8/h5-6H,4H2,1-3H3,(H,12,13)
InChIKeyZHJBMISRGYXHOR-UHFFFAOYSA-N
MW234.26 g/mol
LogP1.26
Rot. Bonds3

About ethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate

ethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate (PubChem CID 155346646) has the molecular formula C11H14N4O2 and a molecular weight of 234.26 g/mol. Its IUPAC name is ethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate.

Molecular Properties

Compound Nameethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate
PubChem CID155346646
Molecular FormulaC11H14N4O2
Molecular Weight234.26 g/mol
Exact Mass234.11
IUPAC Nameethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate
SMILESCCOC(=O)c1cc2c(NC)nc(C)cn2n1
InChIInChI=1S/C11H14N4O2/c1-4-17-11(16)8-5-9-10(12-3)13-7(2)6-15(9)14-8/h5-6H,4H2,1-3H3,(H,12,13)
InChIKeyZHJBMISRGYXHOR-UHFFFAOYSA-N
XLogP1.26
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

ethyl 4-chloro-6-methyl-2-(methylamino)pyridine-3-carboxylate
CID 66930070
ethyl 6-(ethylaminomethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate
CID 114514786
ethyl 4-(methylcarbamoyl)pyrazolo[1,5-a]pyridine-2-carboxylate
CID 59539012
ethyl pyrazolo[1,5-c]quinazoline-2-carboxylate
CID 10610124
4,6-dimethylpyrazolo[1,5-a]pyrazine-2-carboxamide
CID 156754889
ethyl 2-trimethylsilylimidazo[2,1-b][1,3]thiazole-6-carboxylate
CID 125474023
1-(carboxymethyl)-3-ethoxycarbonylpyrazole-5-carboxylic acid
CID 58646658
ethyl 2-methyl-4-(methylamino)-1,3-thiazole-5-carboxylate
CID 67428223
ethane;ethyl 6-methylimidazo[1,2-b]pyridazine-2-carboxylate
CID 171811452
diethyl 4-ethoxypyridine-2,6-dicarboxylate
CID 46708188
ethyl 5-fluoro-1-methylpyrazole-3-carboxylate
CID 155722987
diethyl 1-cyclopentylpyrazole-3,5-dicarboxylate
CID 125461582

Frequently Asked Questions

What is the IUPAC name of ethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate?
The IUPAC name of ethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate (CID 155346646) is ethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate.
What is the SMILES notation for ethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate?
The canonical SMILES for ethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate is CCOC(=O)c1cc2c(NC)nc(C)cn2n1.
What is the InChIKey of ethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate?
The InChIKey is ZHJBMISRGYXHOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2/c1-4-17-11(16)8-5-9-10(12-3)13-7(2)6-15(9)14-8/h5-6H,4H2,1-3H3,(H,12,13).
What are the key properties of ethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate?
ethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate has a molecular weight of 234.26 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 6-methyl-4-(methylamino)pyrazolo[1,5-a]pyrazine-2-carboxylate is sourced from PubChem (CID 155346646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).