2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid

C12H13N3O4 — CID 114006253

IUPAC2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid
SMILESO=C(NCCC(O)C(=O)O)c1cnn2ccccc12
InChIInChI=1S/C12H13N3O4/c16-10(12(18)19)4-5-13-11(17)8-7-14-15-6-2-1-3-9(8)15/h1-3,6-7,10,16H,4-5H2,(H,13,17)(H,18,19)
InChIKeyRZCQRKCFBYLBOF-UHFFFAOYSA-N
MW263.25 g/mol
LogP-0.10
Rot. Bonds5

About 2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid

2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid (PubChem CID 114006253) has the molecular formula C12H13N3O4 and a molecular weight of 263.25 g/mol. Its IUPAC name is 2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid.

Molecular Properties

Compound Name2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid
PubChem CID114006253
Molecular FormulaC12H13N3O4
Molecular Weight263.25 g/mol
Exact Mass263.09
IUPAC Name2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid
SMILESO=C(NCCC(O)C(=O)O)c1cnn2ccccc12
InChIInChI=1S/C12H13N3O4/c16-10(12(18)19)4-5-13-11(17)8-7-14-15-6-2-1-3-9(8)15/h1-3,6-7,10,16H,4-5H2,(H,13,17)(H,18,19)
InChIKeyRZCQRKCFBYLBOF-UHFFFAOYSA-N
XLogP-0.10
TPSA103.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.25
LogP ≤ 5-0.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-hydroxy-3-(pyrazolo[1,5-a]pyridine-3-carbonylamino)propanoic acid
CID 107833160
N-(3-cyanopropyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 113412163
N-(4-bromopentyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 114147488
2-[2-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethylsulfanyl]acetic acid
CID 119241632
N-[2-(ethylamino)ethyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 113265553
N-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 107320901
N-[2-(propylamino)ethyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 113336480
2-hydroxy-4-[(4-oxopyrido[1,2-a]pyrimidine-3-carbonyl)amino]butanoic acid
CID 107832706
N-(3-pyrrolidin-1-ylpropyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 175830935
N-(2-methylprop-2-enyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 104955628
N-phenylpyrazolo[1,5-a]pyridine-3-carboxamide
CID 46882438
N-[2-methyl-3-(methylamino)propyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103806904

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid?
The IUPAC name of 2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid (CID 114006253) is 2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid.
What is the SMILES notation for 2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid?
The canonical SMILES for 2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid is O=C(NCCC(O)C(=O)O)c1cnn2ccccc12.
What is the InChIKey of 2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid?
The InChIKey is RZCQRKCFBYLBOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O4/c16-10(12(18)19)4-5-13-11(17)8-7-14-15-6-2-1-3-9(8)15/h1-3,6-7,10,16H,4-5H2,(H,13,17)(H,18,19).
What are the key properties of 2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid?
2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid has a molecular weight of 263.25 g/mol, XLogP of -0.10, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-4-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid is sourced from PubChem (CID 114006253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).