6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide

C13H20N4O2 — CID 62181516

IUPAC6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide
SMILESCCNc1ccc(C(=O)NCC2CCCCO2)nn1
InChIInChI=1S/C13H20N4O2/c1-2-14-12-7-6-11(16-17-12)13(18)15-9-10-5-3-4-8-19-10/h6-7,10H,2-5,8-9H2,1H3,(H,14,17)(H,15,18)
InChIKeyYNEDSLWMJNESMF-UHFFFAOYSA-N
MW264.33 g/mol
LogP1.21
Rot. Bonds5

About 6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide

6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide (PubChem CID 62181516) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide
PubChem CID62181516
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide
SMILESCCNc1ccc(C(=O)NCC2CCCCO2)nn1
InChIInChI=1S/C13H20N4O2/c1-2-14-12-7-6-11(16-17-12)13(18)15-9-10-5-3-4-8-19-10/h6-7,10H,2-5,8-9H2,1H3,(H,14,17)(H,15,18)
InChIKeyYNEDSLWMJNESMF-UHFFFAOYSA-N
XLogP1.21
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(oxolan-2-ylmethylamino)-N-propylpyridazine-3-carboxamide
CID 109109214
N-(2-methylpropyl)-6-(oxolan-2-ylmethylamino)pyridazine-3-carboxamide
CID 109111164
N-[2-(oxan-2-yl)ethyl]-6-(propylamino)pyridazine-3-carboxamide
CID 106000656
N-(2-methoxyethyl)-6-(oxolan-2-ylmethylamino)pyridazine-3-carboxamide
CID 109113900
6-(3,5-dimethylanilino)-N-(oxolan-2-ylmethyl)pyridazine-3-carboxamide
CID 109115053
6-(oxan-2-ylmethylamino)pyridazine-3-carboxamide
CID 79099568
N-cyclohexyl-6-(oxolan-2-ylmethylamino)pyridazine-3-carboxamide
CID 109112983
6-(4-fluoroanilino)-N-(oxolan-2-ylmethyl)pyridazine-3-carboxamide
CID 109115068
N-(1,4-dioxan-2-ylmethyl)-6-(propylamino)pyridazine-3-carboxamide
CID 62179195
N-cycloheptyl-6-(ethylamino)pyridazine-3-carboxamide
CID 55042572
4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 62173174
N-(2-methylphenyl)-6-(oxolan-2-ylmethylamino)pyridazine-3-carboxamide
CID 109114870

Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide (CID 62181516) is 6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide is CCNc1ccc(C(=O)NCC2CCCCO2)nn1.
What is the InChIKey of 6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide?
The InChIKey is YNEDSLWMJNESMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-2-14-12-7-6-11(16-17-12)13(18)15-9-10-5-3-4-8-19-10/h6-7,10H,2-5,8-9H2,1H3,(H,14,17)(H,15,18).
What are the key properties of 6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide?
6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 1.21, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide is sourced from PubChem (CID 62181516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).