1-(1-pyridin-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid

C15H14N6O2 — CID 84818549

IUPAC1-(1-pyridin-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid
SMILESO=C(O)C1CCCN1c1ncnc2c1cnn2-c1ccccn1
InChIInChI=1S/C15H14N6O2/c22-15(23)11-4-3-7-20(11)13-10-8-19-21(14(10)18-9-17-13)12-5-1-2-6-16-12/h1-2,5-6,8-9,11H,3-4,7H2,(H,22,23)
InChIKeyXEDFCOYJXYDRFT-UHFFFAOYSA-N
MW310.32 g/mol
LogP1.26
Rot. Bonds3

About 1-(1-pyridin-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid

1-(1-pyridin-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid (PubChem CID 84818549) has the molecular formula C15H14N6O2 and a molecular weight of 310.32 g/mol. Its IUPAC name is 1-(1-pyridin-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name1-(1-pyridin-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid
PubChem CID84818549
Molecular FormulaC15H14N6O2
Molecular Weight310.32 g/mol
Exact Mass310.12
IUPAC Name1-(1-pyridin-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid
SMILESO=C(O)C1CCCN1c1ncnc2c1cnn2-c1ccccn1
InChIInChI=1S/C15H14N6O2/c22-15(23)11-4-3-7-20(11)13-10-8-19-21(14(10)18-9-17-13)12-5-1-2-6-16-12/h1-2,5-6,8-9,11H,3-4,7H2,(H,22,23)
InChIKeyXEDFCOYJXYDRFT-UHFFFAOYSA-N
XLogP1.26
TPSA97.03 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.32
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

(2R)-1-(1-phenylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid
CID 122051882
1-phenyl-4-[(2S)-2-pyridin-2-ylpyrrolidin-1-yl]pyrazolo[5,4-d]pyrimidine
CID 94664592
1-phenyl-4-(4-pyridin-2-ylpiperazin-1-yl)pyrazolo[5,4-d]pyrimidine
CID 1050412
(2R)-1-(6-phenylthieno[2,3-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid
CID 28846771
1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid
CID 84818658
4-(2-carboxypyrrolidin-1-yl)quinazoline-7-carboxylic acid;hydrochloride
CID 20982587
1-thieno[2,3-d]pyrimidin-4-ylpiperidine-2-carboxylic acid
CID 43140039
(2S)-1-([1]benzofuro[3,2-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid
CID 6546523
N,N-dimethyl-1-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxamide
CID 42933881
4-(azepan-1-yl)-1-phenylpyrazolo[5,4-d]pyrimidine
CID 915603
1-(1-phenylpyrazolo[5,4-d]pyrimidin-4-yl)piperidin-4-amine
CID 82192144
1-phenyl-4-[(3S)-3-pyridin-2-ylpyrrolidin-1-yl]pyrazolo[5,4-d]pyrimidine
CID 164635273

Frequently Asked Questions

What is the IUPAC name of 1-(1-pyridin-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid?
The IUPAC name of 1-(1-pyridin-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid (CID 84818549) is 1-(1-pyridin-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid.
What is the SMILES notation for 1-(1-pyridin-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid?
The canonical SMILES for 1-(1-pyridin-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid is O=C(O)C1CCCN1c1ncnc2c1cnn2-c1ccccn1.
What is the InChIKey of 1-(1-pyridin-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid?
The InChIKey is XEDFCOYJXYDRFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N6O2/c22-15(23)11-4-3-7-20(11)13-10-8-19-21(14(10)18-9-17-13)12-5-1-2-6-16-12/h1-2,5-6,8-9,11H,3-4,7H2,(H,22,23).
What are the key properties of 1-(1-pyridin-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid?
1-(1-pyridin-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid has a molecular weight of 310.32 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-pyridin-2-ylpyrazolo[5,4-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid is sourced from PubChem (CID 84818549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).