6-hydrazinyl-N-(oxan-3-ylmethyl)pyridazine-3-carboxamide

C11H17N5O2 — CID 62249832

IUPAC6-hydrazinyl-N-(oxan-3-ylmethyl)pyridazine-3-carboxamide
SMILESNNc1ccc(C(=O)NCC2CCCOC2)nn1
InChIInChI=1S/C11H17N5O2/c12-14-10-4-3-9(15-16-10)11(17)13-6-8-2-1-5-18-7-8/h3-4,8H,1-2,5-7,12H2,(H,13,17)(H,14,16)
InChIKeyHEFVIASFMSGGIJ-UHFFFAOYSA-N
MW251.29 g/mol
LogP-0.08
Rot. Bonds4

About 6-hydrazinyl-N-(oxan-3-ylmethyl)pyridazine-3-carboxamide

6-hydrazinyl-N-(oxan-3-ylmethyl)pyridazine-3-carboxamide (PubChem CID 62249832) has the molecular formula C11H17N5O2 and a molecular weight of 251.29 g/mol. Its IUPAC name is 6-hydrazinyl-N-(oxan-3-ylmethyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-hydrazinyl-N-(oxan-3-ylmethyl)pyridazine-3-carboxamide
PubChem CID62249832
Molecular FormulaC11H17N5O2
Molecular Weight251.29 g/mol
Exact Mass251.14
IUPAC Name6-hydrazinyl-N-(oxan-3-ylmethyl)pyridazine-3-carboxamide
SMILESNNc1ccc(C(=O)NCC2CCCOC2)nn1
InChIInChI=1S/C11H17N5O2/c12-14-10-4-3-9(15-16-10)11(17)13-6-8-2-1-5-18-7-8/h3-4,8H,1-2,5-7,12H2,(H,13,17)(H,14,16)
InChIKeyHEFVIASFMSGGIJ-UHFFFAOYSA-N
XLogP-0.08
TPSA102.16 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 5-0.08
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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Related Compounds

4-hydrazinyl-N-(oxan-3-ylmethyl)benzamide
CID 62247297
6-chloro-N-(oxolan-3-ylmethyl)pyridazine-3-carboxamide
CID 61052267
N-(2-cyclohexylethyl)-6-hydrazinylpyridazine-3-carboxamide
CID 62235799
6-hydrazinyl-N-[(2-methylcyclohexyl)methyl]pyridazine-3-carboxamide
CID 55052556
6-hydrazinyl-N-(thian-2-ylmethyl)pyridazine-3-carboxamide
CID 80612211
N-[(1-ethylpyrrolidin-3-yl)methyl]-6-hydrazinylpyridazine-3-carboxamide
CID 62237446
4-amino-N-(oxan-3-ylmethyl)pyridine-3-carboxamide
CID 81240575
2-(oxan-3-ylmethylcarbamoyl)-1,3-thiazole-4-carboxylic acid
CID 116696975
2-amino-4,5-dimethoxy-N-(oxan-3-ylmethyl)benzamide
CID 61140420
4-amino-2-chloro-N-(oxan-3-ylmethyl)benzamide
CID 61140038
N-(oxan-3-ylmethyl)-6-oxo-1H-pyridine-3-carboxamide
CID 47292432
N-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide
CID 63832738

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-(oxan-3-ylmethyl)pyridazine-3-carboxamide?
The IUPAC name of 6-hydrazinyl-N-(oxan-3-ylmethyl)pyridazine-3-carboxamide (CID 62249832) is 6-hydrazinyl-N-(oxan-3-ylmethyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-hydrazinyl-N-(oxan-3-ylmethyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-hydrazinyl-N-(oxan-3-ylmethyl)pyridazine-3-carboxamide is NNc1ccc(C(=O)NCC2CCCOC2)nn1.
What is the InChIKey of 6-hydrazinyl-N-(oxan-3-ylmethyl)pyridazine-3-carboxamide?
The InChIKey is HEFVIASFMSGGIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O2/c12-14-10-4-3-9(15-16-10)11(17)13-6-8-2-1-5-18-7-8/h3-4,8H,1-2,5-7,12H2,(H,13,17)(H,14,16).
What are the key properties of 6-hydrazinyl-N-(oxan-3-ylmethyl)pyridazine-3-carboxamide?
6-hydrazinyl-N-(oxan-3-ylmethyl)pyridazine-3-carboxamide has a molecular weight of 251.29 g/mol, XLogP of -0.08, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(oxan-3-ylmethyl)pyridazine-3-carboxamide is sourced from PubChem (CID 62249832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).