4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylic acid

C12H14N4O3 — CID 104729453

IUPAC4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylic acid
SMILESCc1cc2c(N3CCOC(C(=O)O)C3)nccn2n1
InChIInChI=1S/C12H14N4O3/c1-8-6-9-11(13-2-3-16(9)14-8)15-4-5-19-10(7-15)12(17)18/h2-3,6,10H,4-5,7H2,1H3,(H,17,18)
InChIKeyUQRCHIIKCDTKMV-UHFFFAOYSA-N
MW262.27 g/mol
LogP0.33
Rot. Bonds2

About 4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylic acid

4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylic acid (PubChem CID 104729453) has the molecular formula C12H14N4O3 and a molecular weight of 262.27 g/mol. Its IUPAC name is 4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylic acid.

Molecular Properties

Compound Name4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylic acid
PubChem CID104729453
Molecular FormulaC12H14N4O3
Molecular Weight262.27 g/mol
Exact Mass262.11
IUPAC Name4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylic acid
SMILESCc1cc2c(N3CCOC(C(=O)O)C3)nccn2n1
InChIInChI=1S/C12H14N4O3/c1-8-6-9-11(13-2-3-16(9)14-8)15-4-5-19-10(7-15)12(17)18/h2-3,6,10H,4-5,7H2,1H3,(H,17,18)
InChIKeyUQRCHIIKCDTKMV-UHFFFAOYSA-N
XLogP0.33
TPSA79.96 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

methyl 4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylate
CID 104733435
4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine
CID 133487949
4-(3-chloropyrrolidin-1-yl)-2-methylpyrazolo[1,5-a]pyrazine
CID 104733876
N-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-3-yl]acetamide
CID 133489997
1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-one
CID 104730047
2-methyl-1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pyrrolidine-3-carboxylic acid
CID 104729670
[4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)morpholin-2-yl]-thiomorpholin-4-ylmethanone
CID 146079752
4-[3-(dimethylamino)pyrazin-2-yl]morpholine-2-carboxylic acid
CID 135091284
4-(6-methylthieno[2,3-d]pyrimidin-4-yl)morpholine-2-carboxylic acid
CID 63617713
(3aS,6aR)-2-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)-1,3,4,5,6,6a-hexahydrocyclopenta[c]pyrrole-3a-carboxylic acid
CID 122063173
1-[4-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)morpholin-2-yl]ethanamine
CID 104732835
ethyl 1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidine-4-carboxylate
CID 104733371

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylic acid?
The IUPAC name of 4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylic acid (CID 104729453) is 4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylic acid.
What is the SMILES notation for 4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylic acid?
The canonical SMILES for 4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylic acid is Cc1cc2c(N3CCOC(C(=O)O)C3)nccn2n1.
What is the InChIKey of 4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylic acid?
The InChIKey is UQRCHIIKCDTKMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O3/c1-8-6-9-11(13-2-3-16(9)14-8)15-4-5-19-10(7-15)12(17)18/h2-3,6,10H,4-5,7H2,1H3,(H,17,18).
What are the key properties of 4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylic acid?
4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylic acid has a molecular weight of 262.27 g/mol, XLogP of 0.33, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine-2-carboxylic acid is sourced from PubChem (CID 104729453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).