2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid

C15H19N3O3 — CID 116800823

IUPAC2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid
SMILESCCCc1cc(C(=O)O)cc(Oc2cnn(CCC)c2)n1
InChIInChI=1S/C15H19N3O3/c1-3-5-12-7-11(15(19)20)8-14(17-12)21-13-9-16-18(10-13)6-4-2/h7-10H,3-6H2,1-2H3,(H,19,20)
InChIKeyYOGJJHJLEWCJSU-UHFFFAOYSA-N
MW289.33 g/mol
LogP3.13
Rot. Bonds7

About 2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid

2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid (PubChem CID 116800823) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is 2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid
PubChem CID116800823
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC Name2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid
SMILESCCCc1cc(C(=O)O)cc(Oc2cnn(CCC)c2)n1
InChIInChI=1S/C15H19N3O3/c1-3-5-12-7-11(15(19)20)8-14(17-12)21-13-9-16-18(10-13)6-4-2/h7-10H,3-6H2,1-2H3,(H,19,20)
InChIKeyYOGJJHJLEWCJSU-UHFFFAOYSA-N
XLogP3.13
TPSA77.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-methylpyrazol-4-yl)oxy-6-propylpyridine-4-carboxylic acid
CID 116792579
[2-(1-methylpyrazol-4-yl)oxy-6-propyl-4-pyridinyl]methanol
CID 116793263
1-[6-(1-propylpyrazol-4-yl)oxy-3-pyridinyl]ethanone
CID 116801606
N-[[6-(1-propylpyrazol-4-yl)oxypyrazin-2-yl]methyl]ethanamine
CID 116802960
4-(1-propylpyrazol-4-yl)oxythiophene-2-carboxylic acid
CID 116801908
[2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol
CID 116802650
2,6-dimethyl-4-(1-propylpyrazol-4-yl)oxypyridine-3-carboxylic acid
CID 116803994
2-chloro-4-(1-propylpyrazol-4-yl)oxybenzoic acid
CID 116803992
2-propyl-6-(3,3,3-trifluoropropoxy)pyridine-4-carboxylic acid
CID 113379652
[6-(1-propylpyrazol-4-yl)oxypyridazin-3-yl]methanol
CID 116802649
N-ethyl-4-(1-propylpyrazol-4-yl)oxypyrimidin-2-amine
CID 116806326
N-methyl-6-(1-propylpyrazol-4-yl)oxy-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774804

Frequently Asked Questions

What is the IUPAC name of 2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid?
The IUPAC name of 2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid (CID 116800823) is 2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid.
What is the SMILES notation for 2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid?
The canonical SMILES for 2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid is CCCc1cc(C(=O)O)cc(Oc2cnn(CCC)c2)n1.
What is the InChIKey of 2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid?
The InChIKey is YOGJJHJLEWCJSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-3-5-12-7-11(15(19)20)8-14(17-12)21-13-9-16-18(10-13)6-4-2/h7-10H,3-6H2,1-2H3,(H,19,20).
What are the key properties of 2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid?
2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid has a molecular weight of 289.33 g/mol, XLogP of 3.13, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid is sourced from PubChem (CID 116800823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).