6-hydrazinyl-5-methylpyridine-2-carboxylic acid

C7H9N3O2 — CID 138629654

IUPAC6-hydrazinyl-5-methylpyridine-2-carboxylic acid
SMILESCc1ccc(C(=O)O)nc1NN
InChIInChI=1S/C7H9N3O2/c1-4-2-3-5(7(11)12)9-6(4)10-8/h2-3H,8H2,1H3,(H,9,10)(H,11,12)
InChIKeyQJUPDMJYDREZEZ-UHFFFAOYSA-N
MW167.17 g/mol
LogP0.37
Rot. Bonds2

About 6-hydrazinyl-5-methylpyridine-2-carboxylic acid

6-hydrazinyl-5-methylpyridine-2-carboxylic acid (PubChem CID 138629654) has the molecular formula C7H9N3O2 and a molecular weight of 167.17 g/mol. Its IUPAC name is 6-hydrazinyl-5-methylpyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-hydrazinyl-5-methylpyridine-2-carboxylic acid
PubChem CID138629654
Molecular FormulaC7H9N3O2
Molecular Weight167.17 g/mol
Exact Mass167.07
IUPAC Name6-hydrazinyl-5-methylpyridine-2-carboxylic acid
SMILESCc1ccc(C(=O)O)nc1NN
InChIInChI=1S/C7H9N3O2/c1-4-2-3-5(7(11)12)9-6(4)10-8/h2-3H,8H2,1H3,(H,9,10)(H,11,12)
InChIKeyQJUPDMJYDREZEZ-UHFFFAOYSA-N
XLogP0.37
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 50.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-5-methylpyridine-2-carboxylic acid?
The IUPAC name of 6-hydrazinyl-5-methylpyridine-2-carboxylic acid (CID 138629654) is 6-hydrazinyl-5-methylpyridine-2-carboxylic acid.
What is the SMILES notation for 6-hydrazinyl-5-methylpyridine-2-carboxylic acid?
The canonical SMILES for 6-hydrazinyl-5-methylpyridine-2-carboxylic acid is Cc1ccc(C(=O)O)nc1NN.
What is the InChIKey of 6-hydrazinyl-5-methylpyridine-2-carboxylic acid?
The InChIKey is QJUPDMJYDREZEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2/c1-4-2-3-5(7(11)12)9-6(4)10-8/h2-3H,8H2,1H3,(H,9,10)(H,11,12).
What are the key properties of 6-hydrazinyl-5-methylpyridine-2-carboxylic acid?
6-hydrazinyl-5-methylpyridine-2-carboxylic acid has a molecular weight of 167.17 g/mol, XLogP of 0.37, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-5-methylpyridine-2-carboxylic acid is sourced from PubChem (CID 138629654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).