N-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide

C15H24N4O2 — CID 83035650

IUPACN-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide
SMILESCCCNc1ccc(C(=O)NC2CCOC(C)(C)C2)nn1
InChIInChI=1S/C15H24N4O2/c1-4-8-16-13-6-5-12(18-19-13)14(20)17-11-7-9-21-15(2,3)10-11/h5-6,11H,4,7-10H2,1-3H3,(H,16,19)(H,17,20)
InChIKeyDZKOBJYFFDBUBN-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.99
Rot. Bonds5

About N-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide

N-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide (PubChem CID 83035650) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide
PubChem CID83035650
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide
SMILESCCCNc1ccc(C(=O)NC2CCOC(C)(C)C2)nn1
InChIInChI=1S/C15H24N4O2/c1-4-8-16-13-6-5-12(18-19-13)14(20)17-11-7-9-21-15(2,3)10-11/h5-6,11H,4,7-10H2,1-3H3,(H,16,19)(H,17,20)
InChIKeyDZKOBJYFFDBUBN-UHFFFAOYSA-N
XLogP1.99
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridazine-3-carboxamide
CID 83039941
6-chloro-N-(2,2-dimethyloxan-4-yl)pyridazine-3-carboxamide
CID 83033818
N-(2,2-dimethyloxan-4-yl)-4-(ethylamino)benzamide
CID 83039025
N-(2,2-dimethyloxan-4-yl)-4-(ethylamino)pyridine-2-carboxamide
CID 83039304
N-(1-cyclopropylpyrrolidin-3-yl)-6-(propylamino)pyridazine-3-carboxamide
CID 62174598
N-cyclohexyl-6-(pentylamino)pyridazine-3-carboxamide
CID 109113045
N-(2,2-dimethyloxan-4-yl)-5-(methylamino)pyridine-2-carboxamide
CID 104641994
N-propyl-6-(propylamino)pyridazine-3-carboxamide
CID 62172507
6-bromo-N-(2,2-dimethyloxan-4-yl)pyridine-2-carboxamide
CID 103890092
N-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide
CID 62165513
6-(1-adamantylmethylamino)-N-(oxan-4-yl)pyridazine-3-carboxamide
CID 133381708
N-cycloheptyl-6-(ethylamino)pyridazine-3-carboxamide
CID 55042572

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide?
The IUPAC name of N-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide (CID 83035650) is N-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide?
The canonical SMILES for N-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide is CCCNc1ccc(C(=O)NC2CCOC(C)(C)C2)nn1.
What is the InChIKey of N-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide?
The InChIKey is DZKOBJYFFDBUBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-4-8-16-13-6-5-12(18-19-13)14(20)17-11-7-9-21-15(2,3)10-11/h5-6,11H,4,7-10H2,1-3H3,(H,16,19)(H,17,20).
What are the key properties of N-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide?
N-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.99, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 83035650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).