6-(5-ethylpyrazol-1-yl)pyridine-3-carboxylic acid

C11H11N3O2 — CID 84785161

IUPAC6-(5-ethylpyrazol-1-yl)pyridine-3-carboxylic acid
SMILESCCc1ccnn1-c1ccc(C(=O)O)cn1
InChIInChI=1S/C11H11N3O2/c1-2-9-5-6-13-14(9)10-4-3-8(7-12-10)11(15)16/h3-7H,2H2,1H3,(H,15,16)
InChIKeyYGRZJGLFTFWIQJ-UHFFFAOYSA-N
MW217.23 g/mol
LogP1.53
Rot. Bonds3

About 6-(5-ethylpyrazol-1-yl)pyridine-3-carboxylic acid

6-(5-ethylpyrazol-1-yl)pyridine-3-carboxylic acid (PubChem CID 84785161) has the molecular formula C11H11N3O2 and a molecular weight of 217.23 g/mol. Its IUPAC name is 6-(5-ethylpyrazol-1-yl)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-(5-ethylpyrazol-1-yl)pyridine-3-carboxylic acid
PubChem CID84785161
Molecular FormulaC11H11N3O2
Molecular Weight217.23 g/mol
Exact Mass217.09
IUPAC Name6-(5-ethylpyrazol-1-yl)pyridine-3-carboxylic acid
SMILESCCc1ccnn1-c1ccc(C(=O)O)cn1
InChIInChI=1S/C11H11N3O2/c1-2-9-5-6-13-14(9)10-4-3-8(7-12-10)11(15)16/h3-7H,2H2,1H3,(H,15,16)
InChIKeyYGRZJGLFTFWIQJ-UHFFFAOYSA-N
XLogP1.53
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-ethylpyrazol-1-yl)pyrimidine-4-carboxylic acid
CID 84785997
6-(4-ethylpiperazin-1-yl)pyridine-3-carboxylic acid;hydrochloride
CID 154881659
6-(4,4-diethylpiperidin-1-yl)pyridine-3-carboxylic acid
CID 63161227
6-(4-butanoylpiperazin-1-yl)pyridine-3-carboxylic acid
CID 83967770
6-(2-ethylpyrrolidin-1-yl)pyridine-3-carboxylic acid
CID 60974707
6-piperidin-1-ylpyridine-3-carboxylic acid
CID 2794761
6-(3-hydroxy-3-methylpyrrolidin-1-yl)pyridine-3-carboxylic acid
CID 103356410
2-(5-ethylpyrazol-1-yl)pyrimidin-5-amine
CID 84771114
3-ethylimidazo[1,2-a]pyridine-6-carboxylic acid
CID 62651900
6-(4-chloropyrazol-1-yl)pyridine-3-carboxylic acid
CID 61036048
6-(3-ethoxycarbonylpyrazol-1-yl)pyridine-3-carboxylic acid
CID 89463371
6-(2,2-dimethylmorpholin-4-yl)pyridine-3-carboxylic acid
CID 43593037

Frequently Asked Questions

What is the IUPAC name of 6-(5-ethylpyrazol-1-yl)pyridine-3-carboxylic acid?
The IUPAC name of 6-(5-ethylpyrazol-1-yl)pyridine-3-carboxylic acid (CID 84785161) is 6-(5-ethylpyrazol-1-yl)pyridine-3-carboxylic acid.
What is the SMILES notation for 6-(5-ethylpyrazol-1-yl)pyridine-3-carboxylic acid?
The canonical SMILES for 6-(5-ethylpyrazol-1-yl)pyridine-3-carboxylic acid is CCc1ccnn1-c1ccc(C(=O)O)cn1.
What is the InChIKey of 6-(5-ethylpyrazol-1-yl)pyridine-3-carboxylic acid?
The InChIKey is YGRZJGLFTFWIQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2/c1-2-9-5-6-13-14(9)10-4-3-8(7-12-10)11(15)16/h3-7H,2H2,1H3,(H,15,16).
What are the key properties of 6-(5-ethylpyrazol-1-yl)pyridine-3-carboxylic acid?
6-(5-ethylpyrazol-1-yl)pyridine-3-carboxylic acid has a molecular weight of 217.23 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-ethylpyrazol-1-yl)pyridine-3-carboxylic acid is sourced from PubChem (CID 84785161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).