pyridine-4-carbohydrazide

C6H7N3O — CID 3767

IUPACpyridine-4-carbohydrazide
SMILESNNC(=O)c1ccncc1
InChIInChI=1S/C6H7N3O/c7-9-6(10)5-1-3-8-4-2-5/h1-4H,7H2,(H,9,10)
InChIKeyQRXWMOHMRWLFEY-UHFFFAOYSA-N
MW137.14 g/mol
LogP-0.31
Rot. Bonds1

About pyridine-4-carbohydrazide

pyridine-4-carbohydrazide (PubChem CID 3767) has the molecular formula C6H7N3O and a molecular weight of 137.14 g/mol. Its IUPAC name is pyridine-4-carbohydrazide.

Molecular Properties

Compound Namepyridine-4-carbohydrazide
PubChem CID3767
Molecular FormulaC6H7N3O
Molecular Weight137.14 g/mol
Exact Mass137.06
IUPAC Namepyridine-4-carbohydrazide
SMILESNNC(=O)c1ccncc1
InChIInChI=1S/C6H7N3O/c7-9-6(10)5-1-3-8-4-2-5/h1-4H,7H2,(H,9,10)
InChIKeyQRXWMOHMRWLFEY-UHFFFAOYSA-N
XLogP-0.31
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.14
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'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 pyridine-4-carbohydrazide?
The IUPAC name of pyridine-4-carbohydrazide (CID 3767) is pyridine-4-carbohydrazide.
What is the SMILES notation for pyridine-4-carbohydrazide?
The canonical SMILES for pyridine-4-carbohydrazide is NNC(=O)c1ccncc1.
What is the InChIKey of pyridine-4-carbohydrazide?
The InChIKey is QRXWMOHMRWLFEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3O/c7-9-6(10)5-1-3-8-4-2-5/h1-4H,7H2,(H,9,10).
What are the key properties of pyridine-4-carbohydrazide?
pyridine-4-carbohydrazide has a molecular weight of 137.14 g/mol, XLogP of -0.31, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyridine-4-carbohydrazide is sourced from PubChem (CID 3767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).