6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide

C9H15N5O2 — CID 62236681

IUPAC6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide
SMILESCOCC(C)NC(=O)c1ccc(NN)nn1
InChIInChI=1S/C9H15N5O2/c1-6(5-16-2)11-9(15)7-3-4-8(12-10)14-13-7/h3-4,6H,5,10H2,1-2H3,(H,11,15)(H,12,14)
InChIKeyUIEXSVCRVXGANL-UHFFFAOYSA-N
MW225.25 g/mol
LogP-0.47
Rot. Bonds5

About 6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide

6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide (PubChem CID 62236681) has the molecular formula C9H15N5O2 and a molecular weight of 225.25 g/mol. Its IUPAC name is 6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide
PubChem CID62236681
Molecular FormulaC9H15N5O2
Molecular Weight225.25 g/mol
Exact Mass225.12
IUPAC Name6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide
SMILESCOCC(C)NC(=O)c1ccc(NN)nn1
InChIInChI=1S/C9H15N5O2/c1-6(5-16-2)11-9(15)7-3-4-8(12-10)14-13-7/h3-4,6H,5,10H2,1-2H3,(H,11,15)(H,12,14)
InChIKeyUIEXSVCRVXGANL-UHFFFAOYSA-N
XLogP-0.47
TPSA102.16 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-0.47
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 6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide?
The IUPAC name of 6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide (CID 62236681) is 6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide?
The canonical SMILES for 6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide is COCC(C)NC(=O)c1ccc(NN)nn1.
What is the InChIKey of 6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide?
The InChIKey is UIEXSVCRVXGANL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5O2/c1-6(5-16-2)11-9(15)7-3-4-8(12-10)14-13-7/h3-4,6H,5,10H2,1-2H3,(H,11,15)(H,12,14).
What are the key properties of 6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide?
6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide has a molecular weight of 225.25 g/mol, XLogP of -0.47, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(1-methoxypropan-2-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 62236681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).