2-propyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylic acid

C14H18N4O2 — CID 106977575

IUPAC2-propyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylic acid
SMILESCCCC1(C(=O)O)CCCN1c1nccn2nccc12
InChIInChI=1S/C14H18N4O2/c1-2-5-14(13(19)20)6-3-9-17(14)12-11-4-7-16-18(11)10-8-15-12/h4,7-8,10H,2-3,5-6,9H2,1H3,(H,19,20)
InChIKeyASIZSKYUHPIJGS-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.95
Rot. Bonds4

About 2-propyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylic acid

2-propyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylic acid (PubChem CID 106977575) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-propyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name2-propyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylic acid
PubChem CID106977575
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name2-propyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylic acid
SMILESCCCC1(C(=O)O)CCCN1c1nccn2nccc12
InChIInChI=1S/C14H18N4O2/c1-2-5-14(13(19)20)6-3-9-17(14)12-11-4-7-16-18(11)10-8-15-12/h4,7-8,10H,2-3,5-6,9H2,1H3,(H,19,20)
InChIKeyASIZSKYUHPIJGS-UHFFFAOYSA-N
XLogP1.95
TPSA70.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-chloro-4-cyano-2-pyridinyl)-2-propylpyrrolidine-2-carboxylic acid
CID 107056599
2-propyl-1-quinazolin-4-ylpyrrolidine-2-carboxylic acid
CID 106977669
1-(2-carbamoyl-4-pyridinyl)-2-propylpyrrolidine-2-carboxylic acid
CID 106977589
1-phthalazin-1-yl-2-propylpyrrolidine-2-carboxylic acid
CID 106977500
2-propyl-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidine-2-carboxylic acid
CID 106977674
2-propyl-1-(7H-purin-6-yl)pyrrolidine-2-carboxylic acid
CID 106977510
2-propyl-1-quinoxalin-2-ylpyrrolidine-2-carboxylic acid
CID 106977590
1-(4-propan-2-yloxypyrimidin-2-yl)-2-propylpyrrolidine-2-carboxylic acid
CID 106977681
1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)-2-propylpyrrolidine-2-carboxylic acid
CID 106977559
1-(4,6-dimethoxypyrimidin-2-yl)-2-propylpyrrolidine-2-carboxylic acid
CID 106977561
1-(4-methyl-1,3-thiazol-2-yl)-2-propylpyrrolidine-2-carboxylic acid
CID 106977692
1-(6-propoxypyrazin-2-yl)-2-propylpyrrolidine-2-carboxylic acid
CID 106977706

Frequently Asked Questions

What is the IUPAC name of 2-propyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylic acid?
The IUPAC name of 2-propyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylic acid (CID 106977575) is 2-propyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylic acid.
What is the SMILES notation for 2-propyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylic acid?
The canonical SMILES for 2-propyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylic acid is CCCC1(C(=O)O)CCCN1c1nccn2nccc12.
What is the InChIKey of 2-propyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylic acid?
The InChIKey is ASIZSKYUHPIJGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-2-5-14(13(19)20)6-3-9-17(14)12-11-4-7-16-18(11)10-8-15-12/h4,7-8,10H,2-3,5-6,9H2,1H3,(H,19,20).
What are the key properties of 2-propyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylic acid?
2-propyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylic acid has a molecular weight of 274.32 g/mol, XLogP of 1.95, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylic acid is sourced from PubChem (CID 106977575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).