3-hydrazinyl-N-(1,2-oxazol-3-yl)pyridine-4-carboxamide

C9H9N5O2 — CID 105072109

IUPAC3-hydrazinyl-N-(1,2-oxazol-3-yl)pyridine-4-carboxamide
SMILESNNc1cnccc1C(=O)Nc1ccon1
InChIInChI=1S/C9H9N5O2/c10-13-7-5-11-3-1-6(7)9(15)12-8-2-4-16-14-8/h1-5,13H,10H2,(H,12,14,15)
InChIKeyPFSJDCPQWWEKFN-UHFFFAOYSA-N
MW219.20 g/mol
LogP0.61
Rot. Bonds3

About 3-hydrazinyl-N-(1,2-oxazol-3-yl)pyridine-4-carboxamide

3-hydrazinyl-N-(1,2-oxazol-3-yl)pyridine-4-carboxamide (PubChem CID 105072109) has the molecular formula C9H9N5O2 and a molecular weight of 219.20 g/mol. Its IUPAC name is 3-hydrazinyl-N-(1,2-oxazol-3-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-hydrazinyl-N-(1,2-oxazol-3-yl)pyridine-4-carboxamide
PubChem CID105072109
Molecular FormulaC9H9N5O2
Molecular Weight219.20 g/mol
Exact Mass219.08
IUPAC Name3-hydrazinyl-N-(1,2-oxazol-3-yl)pyridine-4-carboxamide
SMILESNNc1cnccc1C(=O)Nc1ccon1
InChIInChI=1S/C9H9N5O2/c10-13-7-5-11-3-1-6(7)9(15)12-8-2-4-16-14-8/h1-5,13H,10H2,(H,12,14,15)
InChIKeyPFSJDCPQWWEKFN-UHFFFAOYSA-N
XLogP0.61
TPSA106.07 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.20
LogP ≤ 50.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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 3-hydrazinyl-N-(1,2-oxazol-3-yl)pyridine-4-carboxamide?
The IUPAC name of 3-hydrazinyl-N-(1,2-oxazol-3-yl)pyridine-4-carboxamide (CID 105072109) is 3-hydrazinyl-N-(1,2-oxazol-3-yl)pyridine-4-carboxamide.
What is the SMILES notation for 3-hydrazinyl-N-(1,2-oxazol-3-yl)pyridine-4-carboxamide?
The canonical SMILES for 3-hydrazinyl-N-(1,2-oxazol-3-yl)pyridine-4-carboxamide is NNc1cnccc1C(=O)Nc1ccon1.
What is the InChIKey of 3-hydrazinyl-N-(1,2-oxazol-3-yl)pyridine-4-carboxamide?
The InChIKey is PFSJDCPQWWEKFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N5O2/c10-13-7-5-11-3-1-6(7)9(15)12-8-2-4-16-14-8/h1-5,13H,10H2,(H,12,14,15).
What are the key properties of 3-hydrazinyl-N-(1,2-oxazol-3-yl)pyridine-4-carboxamide?
3-hydrazinyl-N-(1,2-oxazol-3-yl)pyridine-4-carboxamide has a molecular weight of 219.20 g/mol, XLogP of 0.61, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydrazinyl-N-(1,2-oxazol-3-yl)pyridine-4-carboxamide is sourced from PubChem (CID 105072109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).