6-(2-prop-1-enylhydrazinyl)pyridine-3-carboxylic acid

C9H11N3O2 — CID 70287368

IUPAC6-(2-prop-1-enylhydrazinyl)pyridine-3-carboxylic acid
SMILESCC=CNNc1ccc(C(=O)O)cn1
InChIInChI=1S/C9H11N3O2/c1-2-5-11-12-8-4-3-7(6-10-8)9(13)14/h2-6,11H,1H3,(H,10,12)(H,13,14)
InChIKeyHGOVSRMRAXSSEV-UHFFFAOYSA-N
MW193.21 g/mol
LogP1.23
Rot. Bonds4

About 6-(2-prop-1-enylhydrazinyl)pyridine-3-carboxylic acid

6-(2-prop-1-enylhydrazinyl)pyridine-3-carboxylic acid (PubChem CID 70287368) has the molecular formula C9H11N3O2 and a molecular weight of 193.21 g/mol. Its IUPAC name is 6-(2-prop-1-enylhydrazinyl)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-(2-prop-1-enylhydrazinyl)pyridine-3-carboxylic acid
PubChem CID70287368
Molecular FormulaC9H11N3O2
Molecular Weight193.21 g/mol
Exact Mass193.09
IUPAC Name6-(2-prop-1-enylhydrazinyl)pyridine-3-carboxylic acid
SMILESCC=CNNc1ccc(C(=O)O)cn1
InChIInChI=1S/C9H11N3O2/c1-2-5-11-12-8-4-3-7(6-10-8)9(13)14/h2-6,11H,1H3,(H,10,12)(H,13,14)
InChIKeyHGOVSRMRAXSSEV-UHFFFAOYSA-N
XLogP1.23
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 51.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(2-prop-1-enylhydrazinyl)pyridine-3-carboxylic acid?
The IUPAC name of 6-(2-prop-1-enylhydrazinyl)pyridine-3-carboxylic acid (CID 70287368) is 6-(2-prop-1-enylhydrazinyl)pyridine-3-carboxylic acid.
What is the SMILES notation for 6-(2-prop-1-enylhydrazinyl)pyridine-3-carboxylic acid?
The canonical SMILES for 6-(2-prop-1-enylhydrazinyl)pyridine-3-carboxylic acid is CC=CNNc1ccc(C(=O)O)cn1.
What is the InChIKey of 6-(2-prop-1-enylhydrazinyl)pyridine-3-carboxylic acid?
The InChIKey is HGOVSRMRAXSSEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2/c1-2-5-11-12-8-4-3-7(6-10-8)9(13)14/h2-6,11H,1H3,(H,10,12)(H,13,14).
What are the key properties of 6-(2-prop-1-enylhydrazinyl)pyridine-3-carboxylic acid?
6-(2-prop-1-enylhydrazinyl)pyridine-3-carboxylic acid has a molecular weight of 193.21 g/mol, XLogP of 1.23, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-prop-1-enylhydrazinyl)pyridine-3-carboxylic acid is sourced from PubChem (CID 70287368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).