3-[1-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethyl]-1,2-oxazole-5-carboxylic acid

C14H12N4O4 — CID 77453745

IUPAC3-[1-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethyl]-1,2-oxazole-5-carboxylic acid
SMILESCC(NC(=O)c1cnn2ccccc12)c1cc(C(=O)O)on1
InChIInChI=1S/C14H12N4O4/c1-8(10-6-12(14(20)21)22-17-10)16-13(19)9-7-15-18-5-3-2-4-11(9)18/h2-8H,1H3,(H,16,19)(H,20,21)
InChIKeyYRTICVAGGMGXEM-UHFFFAOYSA-N
MW300.27 g/mol
LogP1.51
Rot. Bonds4

About 3-[1-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethyl]-1,2-oxazole-5-carboxylic acid

3-[1-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethyl]-1,2-oxazole-5-carboxylic acid (PubChem CID 77453745) has the molecular formula C14H12N4O4 and a molecular weight of 300.27 g/mol. Its IUPAC name is 3-[1-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethyl]-1,2-oxazole-5-carboxylic acid.

Molecular Properties

Compound Name3-[1-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethyl]-1,2-oxazole-5-carboxylic acid
PubChem CID77453745
Molecular FormulaC14H12N4O4
Molecular Weight300.27 g/mol
Exact Mass300.09
IUPAC Name3-[1-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethyl]-1,2-oxazole-5-carboxylic acid
SMILESCC(NC(=O)c1cnn2ccccc12)c1cc(C(=O)O)on1
InChIInChI=1S/C14H12N4O4/c1-8(10-6-12(14(20)21)22-17-10)16-13(19)9-7-15-18-5-3-2-4-11(9)18/h2-8H,1H3,(H,16,19)(H,20,21)
InChIKeyYRTICVAGGMGXEM-UHFFFAOYSA-N
XLogP1.51
TPSA109.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.27
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(1R)-1-[5-[2-[2-methoxy-5-(trifluoromethyl)phenyl]acetyl]-1,2-oxazol-3-yl]ethyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 160750688
N-(1-chloro-3-methylbutan-2-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103122641
N-[(1R)-1-(1-benzothiophen-3-yl)ethyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 166341655
3-methyl-2-(pyrazolo[1,5-a]pyridine-3-carbonylamino)pentanoic acid
CID 103790711
N-[1-(2H-tetrazol-5-yl)ethyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103120449
N-(4-hydroxypentan-2-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 113384187
N-(3-oxopentan-2-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103118085
N-(1,1-dimethoxypropan-2-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103118082
N-(1-chloro-4-methylpentan-2-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103122593
N-(1-chloro-4-methylpentan-3-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 106354930
N-phenylpyrazolo[1,5-a]pyridine-3-carboxamide
CID 46882438
N-(1-bromobutan-2-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103122664

Frequently Asked Questions

What is the IUPAC name of 3-[1-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethyl]-1,2-oxazole-5-carboxylic acid?
The IUPAC name of 3-[1-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethyl]-1,2-oxazole-5-carboxylic acid (CID 77453745) is 3-[1-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethyl]-1,2-oxazole-5-carboxylic acid.
What is the SMILES notation for 3-[1-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethyl]-1,2-oxazole-5-carboxylic acid?
The canonical SMILES for 3-[1-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethyl]-1,2-oxazole-5-carboxylic acid is CC(NC(=O)c1cnn2ccccc12)c1cc(C(=O)O)on1.
What is the InChIKey of 3-[1-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethyl]-1,2-oxazole-5-carboxylic acid?
The InChIKey is YRTICVAGGMGXEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O4/c1-8(10-6-12(14(20)21)22-17-10)16-13(19)9-7-15-18-5-3-2-4-11(9)18/h2-8H,1H3,(H,16,19)(H,20,21).
What are the key properties of 3-[1-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethyl]-1,2-oxazole-5-carboxylic acid?
3-[1-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethyl]-1,2-oxazole-5-carboxylic acid has a molecular weight of 300.27 g/mol, XLogP of 1.51, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(pyrazolo[1,5-a]pyridine-3-carbonylamino)ethyl]-1,2-oxazole-5-carboxylic acid is sourced from PubChem (CID 77453745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).