3-(pyrazol-1-ylmethyl)pyridine-2-carboxylic acid

C10H9N3O2 — CID 63073383

IUPAC3-(pyrazol-1-ylmethyl)pyridine-2-carboxylic acid
SMILESO=C(O)c1ncccc1Cn1cccn1
InChIInChI=1S/C10H9N3O2/c14-10(15)9-8(3-1-4-11-9)7-13-6-2-5-12-13/h1-6H,7H2,(H,14,15)
InChIKeyFOXOGHILIMIYDP-UHFFFAOYSA-N
MW203.20 g/mol
LogP1.02
Rot. Bonds3

About 3-(pyrazol-1-ylmethyl)pyridine-2-carboxylic acid

3-(pyrazol-1-ylmethyl)pyridine-2-carboxylic acid (PubChem CID 63073383) has the molecular formula C10H9N3O2 and a molecular weight of 203.20 g/mol. Its IUPAC name is 3-(pyrazol-1-ylmethyl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name3-(pyrazol-1-ylmethyl)pyridine-2-carboxylic acid
PubChem CID63073383
Molecular FormulaC10H9N3O2
Molecular Weight203.20 g/mol
Exact Mass203.07
IUPAC Name3-(pyrazol-1-ylmethyl)pyridine-2-carboxylic acid
SMILESO=C(O)c1ncccc1Cn1cccn1
InChIInChI=1S/C10H9N3O2/c14-10(15)9-8(3-1-4-11-9)7-13-6-2-5-12-13/h1-6H,7H2,(H,14,15)
InChIKeyFOXOGHILIMIYDP-UHFFFAOYSA-N
XLogP1.02
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(4-methylpyrazol-1-yl)methyl]pyridine-2-carboxylic acid
CID 63073046
acetic acid;3-ethylpyridine-2-carboxylic acid
CID 118035690
3-[[16-[(2-carboxy-3-pyridinyl)methyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]methyl]pyridine-2-carboxylic acid
CID 174155383
3-[(4-methylpiperidin-1-yl)methyl]pyridine-2-carboxylic acid
CID 55145932
3-(methylsulfonylmethyl)pyridine-2-carboxylic acid
CID 153267401
3-[(2-ethylbenzimidazol-1-yl)methyl]pyridine-2-carboxylic acid
CID 63107308
3-[(2,4-dimethylpiperidin-1-yl)methyl]pyridine-2-carboxylic acid
CID 55145764
3-[(2,4-dimethylpiperazin-1-yl)methyl]pyridine-2-carboxylic acid
CID 114087968
3-[(3-methylpiperidin-1-yl)methyl]pyridine-2-carboxylic acid
CID 55146885
3-[(2-ethylphenoxy)methyl]pyridine-2-carboxylic acid
CID 63074333
3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid
CID 63074878
3-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]pyridine-2-carboxylic acid
CID 63073904

Frequently Asked Questions

What is the IUPAC name of 3-(pyrazol-1-ylmethyl)pyridine-2-carboxylic acid?
The IUPAC name of 3-(pyrazol-1-ylmethyl)pyridine-2-carboxylic acid (CID 63073383) is 3-(pyrazol-1-ylmethyl)pyridine-2-carboxylic acid.
What is the SMILES notation for 3-(pyrazol-1-ylmethyl)pyridine-2-carboxylic acid?
The canonical SMILES for 3-(pyrazol-1-ylmethyl)pyridine-2-carboxylic acid is O=C(O)c1ncccc1Cn1cccn1.
What is the InChIKey of 3-(pyrazol-1-ylmethyl)pyridine-2-carboxylic acid?
The InChIKey is FOXOGHILIMIYDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O2/c14-10(15)9-8(3-1-4-11-9)7-13-6-2-5-12-13/h1-6H,7H2,(H,14,15).
What are the key properties of 3-(pyrazol-1-ylmethyl)pyridine-2-carboxylic acid?
3-(pyrazol-1-ylmethyl)pyridine-2-carboxylic acid has a molecular weight of 203.20 g/mol, XLogP of 1.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(pyrazol-1-ylmethyl)pyridine-2-carboxylic acid is sourced from PubChem (CID 63073383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).