5-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid

C11H10N4O4 — CID 106406192

IUPAC5-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid
SMILESO=C(NCCc1ncon1)c1ccc(C(=O)O)nc1
InChIInChI=1S/C11H10N4O4/c16-10(12-4-3-9-14-6-19-15-9)7-1-2-8(11(17)18)13-5-7/h1-2,5-6H,3-4H2,(H,12,16)(H,17,18)
InChIKeyAHZQVMUGMXLEQW-UHFFFAOYSA-N
MW262.23 g/mol
LogP0.14
Rot. Bonds5

About 5-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid

5-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid (PubChem CID 106406192) has the molecular formula C11H10N4O4 and a molecular weight of 262.23 g/mol. Its IUPAC name is 5-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid
PubChem CID106406192
Molecular FormulaC11H10N4O4
Molecular Weight262.23 g/mol
Exact Mass262.07
IUPAC Name5-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid
SMILESO=C(NCCc1ncon1)c1ccc(C(=O)O)nc1
InChIInChI=1S/C11H10N4O4/c16-10(12-4-3-9-14-6-19-15-9)7-1-2-8(11(17)18)13-5-7/h1-2,5-6H,3-4H2,(H,12,16)(H,17,18)
InChIKeyAHZQVMUGMXLEQW-UHFFFAOYSA-N
XLogP0.14
TPSA118.21 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.23
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-(ethylamino)-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide
CID 106409133
5-[2-(4-bromophenyl)ethylcarbamoyl]pyridine-2-carboxylic acid
CID 154857316
N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 113238381
3-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-4-(propylamino)benzamide
CID 106409151
4-(4-hydroxybut-1-ynyl)-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzamide
CID 106406745
3-amino-4-(dimethylamino)-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzamide
CID 106391732
5-(2-pyrrolidin-1-ylethylcarbamoyl)pyridine-2-carboxylic acid
CID 60725088
5-(4-methoxybutylcarbamoyl)pyridine-2-carboxylic acid
CID 60769978
3-amino-5-fluoro-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzamide
CID 114182827
5-[2-(4-methyl-1,2,4-triazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid
CID 63331300
5-(3-sulfamoylpropylcarbamoyl)pyridine-2-carboxylic acid
CID 61150263
5-[[3-(diethylamino)-3-oxopropyl]carbamoyl]pyridine-2-carboxylic acid
CID 115588687

Frequently Asked Questions

What is the IUPAC name of 5-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid?
The IUPAC name of 5-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid (CID 106406192) is 5-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid.
What is the SMILES notation for 5-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid?
The canonical SMILES for 5-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid is O=C(NCCc1ncon1)c1ccc(C(=O)O)nc1.
What is the InChIKey of 5-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid?
The InChIKey is AHZQVMUGMXLEQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O4/c16-10(12-4-3-9-14-6-19-15-9)7-1-2-8(11(17)18)13-5-7/h1-2,5-6H,3-4H2,(H,12,16)(H,17,18).
What are the key properties of 5-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid?
5-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid has a molecular weight of 262.23 g/mol, XLogP of 0.14, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-2-carboxylic acid is sourced from PubChem (CID 106406192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).