N-(oxan-4-yl)-6-[1-(oxolan-2-yl)propylamino]pyridazine-3-carboxamide

C17H26N4O3 — CID 133417973

IUPACN-(oxan-4-yl)-6-[1-(oxolan-2-yl)propylamino]pyridazine-3-carboxamide
SMILESCCC(Nc1ccc(C(=O)NC2CCOCC2)nn1)C1CCCO1
InChIInChI=1S/C17H26N4O3/c1-2-13(15-4-3-9-24-15)19-16-6-5-14(20-21-16)17(22)18-12-7-10-23-11-8-12/h5-6,12-13,15H,2-4,7-11H2,1H3,(H,18,22)(H,19,21)
InChIKeyXEOIUNOXNWZSQH-UHFFFAOYSA-N
MW334.42 g/mol
LogP1.75
Rot. Bonds6

About N-(oxan-4-yl)-6-[1-(oxolan-2-yl)propylamino]pyridazine-3-carboxamide

N-(oxan-4-yl)-6-[1-(oxolan-2-yl)propylamino]pyridazine-3-carboxamide (PubChem CID 133417973) has the molecular formula C17H26N4O3 and a molecular weight of 334.42 g/mol. Its IUPAC name is N-(oxan-4-yl)-6-[1-(oxolan-2-yl)propylamino]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(oxan-4-yl)-6-[1-(oxolan-2-yl)propylamino]pyridazine-3-carboxamide
PubChem CID133417973
Molecular FormulaC17H26N4O3
Molecular Weight334.42 g/mol
Exact Mass334.20
IUPAC NameN-(oxan-4-yl)-6-[1-(oxolan-2-yl)propylamino]pyridazine-3-carboxamide
SMILESCCC(Nc1ccc(C(=O)NC2CCOCC2)nn1)C1CCCO1
InChIInChI=1S/C17H26N4O3/c1-2-13(15-4-3-9-24-15)19-16-6-5-14(20-21-16)17(22)18-12-7-10-23-11-8-12/h5-6,12-13,15H,2-4,7-11H2,1H3,(H,18,22)(H,19,21)
InChIKeyXEOIUNOXNWZSQH-UHFFFAOYSA-N
XLogP1.75
TPSA85.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-[(1-ethylpyrrolidin-2-yl)methylamino]-N-(oxan-4-yl)pyridazine-3-carboxamide
CID 133382089
6-(butan-2-ylamino)-N-cyclohexylpyridazine-3-carboxamide
CID 109111349
6-[1-(5-ethyl-4-methylthiophen-2-yl)ethylamino]-N-(oxan-4-yl)pyridazine-3-carboxamide
CID 133412817
N-(oxan-4-yl)-6-[(1-propylpiperidin-4-yl)amino]pyridazine-3-carboxamide
CID 133383535
N-cyclohexyl-6-(oxolan-2-ylmethylamino)pyridazine-3-carboxamide
CID 109112983
6-(3-fluoro-4-methylanilino)-N-(oxan-4-yl)pyridazine-3-carboxamide
CID 133381848
N-(oxan-4-yl)-6-[[phenyl(pyridin-2-yl)methyl]amino]pyridazine-3-carboxamide
CID 133382565
6-(1-adamantylmethylamino)-N-(oxan-4-yl)pyridazine-3-carboxamide
CID 133381708
N-cycloheptyl-6-(ethylamino)pyridazine-3-carboxamide
CID 55042572
6-[1-(1-benzylpyrazol-4-yl)ethylamino]-N-(oxan-4-yl)pyridazine-3-carboxamide
CID 133416851
6-(ethylamino)-N-(4-hydroxycyclohexyl)pyridazine-3-carboxamide
CID 55042745
6-[(2,5-dimethyl-1,3-thiazol-4-yl)methylamino]-N-(oxan-4-yl)pyridazine-3-carboxamide
CID 133406333

Frequently Asked Questions

What is the IUPAC name of N-(oxan-4-yl)-6-[1-(oxolan-2-yl)propylamino]pyridazine-3-carboxamide?
The IUPAC name of N-(oxan-4-yl)-6-[1-(oxolan-2-yl)propylamino]pyridazine-3-carboxamide (CID 133417973) is N-(oxan-4-yl)-6-[1-(oxolan-2-yl)propylamino]pyridazine-3-carboxamide.
What is the SMILES notation for N-(oxan-4-yl)-6-[1-(oxolan-2-yl)propylamino]pyridazine-3-carboxamide?
The canonical SMILES for N-(oxan-4-yl)-6-[1-(oxolan-2-yl)propylamino]pyridazine-3-carboxamide is CCC(Nc1ccc(C(=O)NC2CCOCC2)nn1)C1CCCO1.
What is the InChIKey of N-(oxan-4-yl)-6-[1-(oxolan-2-yl)propylamino]pyridazine-3-carboxamide?
The InChIKey is XEOIUNOXNWZSQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O3/c1-2-13(15-4-3-9-24-15)19-16-6-5-14(20-21-16)17(22)18-12-7-10-23-11-8-12/h5-6,12-13,15H,2-4,7-11H2,1H3,(H,18,22)(H,19,21).
What are the key properties of N-(oxan-4-yl)-6-[1-(oxolan-2-yl)propylamino]pyridazine-3-carboxamide?
N-(oxan-4-yl)-6-[1-(oxolan-2-yl)propylamino]pyridazine-3-carboxamide has a molecular weight of 334.42 g/mol, XLogP of 1.75, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxan-4-yl)-6-[1-(oxolan-2-yl)propylamino]pyridazine-3-carboxamide is sourced from PubChem (CID 133417973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).