N-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide

C15H23N5O — CID 62165513

IUPACN-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide
SMILESCCCNc1ccc(C(=O)NC2CN3CCC2CC3)nn1
InChIInChI=1S/C15H23N5O/c1-2-7-16-14-4-3-12(18-19-14)15(21)17-13-10-20-8-5-11(13)6-9-20/h3-4,11,13H,2,5-10H2,1H3,(H,16,19)(H,17,21)
InChIKeyIGNDEIPSLBPNTI-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.12
Rot. Bonds5

About N-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide

N-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide (PubChem CID 62165513) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is N-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide
PubChem CID62165513
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC NameN-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide
SMILESCCCNc1ccc(C(=O)NC2CN3CCC2CC3)nn1
InChIInChI=1S/C15H23N5O/c1-2-7-16-14-4-3-12(18-19-14)15(21)17-13-10-20-8-5-11(13)6-9-20/h3-4,11,13H,2,5-10H2,1H3,(H,16,19)(H,17,21)
InChIKeyIGNDEIPSLBPNTI-UHFFFAOYSA-N
XLogP1.12
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-cyclopropylpyrrolidin-3-yl)-6-(propylamino)pyridazine-3-carboxamide
CID 62174598
N-(1-azabicyclo[2.2.2]octan-3-yl)-6-chloropyridazine-3-carboxamide
CID 60858694
6-amino-N-(1-azabicyclo[2.2.2]octan-3-yl)pyridazine-3-carboxamide
CID 62154374
N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(ethylamino)pyrazine-2-carboxamide
CID 107374254
N-propyl-6-(propylamino)pyridazine-3-carboxamide
CID 62172507
N-(1-azabicyclo[2.2.2]octan-3-yl)-4-(ethylamino)pyridine-2-carboxamide
CID 62167266
N-(2,2-dimethyloxan-4-yl)-6-(propylamino)pyridazine-3-carboxamide
CID 83035650
N-cyclohexyl-6-(pentylamino)pyridazine-3-carboxamide
CID 109113045
(4-hydroxypiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone
CID 55042518
N-pentan-2-yl-6-(propylamino)pyridazine-3-carboxamide
CID 62185105
2-N-(1-azabicyclo[2.2.2]octan-3-yl)-6-N-propylpyrazine-2,6-diamine
CID 80778324
N-(1-azabicyclo[2.2.2]octan-3-yl)-4-propoxybenzamide
CID 5136899

Frequently Asked Questions

What is the IUPAC name of N-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide?
The IUPAC name of N-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide (CID 62165513) is N-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide?
The canonical SMILES for N-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide is CCCNc1ccc(C(=O)NC2CN3CCC2CC3)nn1.
What is the InChIKey of N-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide?
The InChIKey is IGNDEIPSLBPNTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-2-7-16-14-4-3-12(18-19-14)15(21)17-13-10-20-8-5-11(13)6-9-20/h3-4,11,13H,2,5-10H2,1H3,(H,16,19)(H,17,21).
What are the key properties of N-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide?
N-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 1.12, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-azabicyclo[2.2.2]octan-3-yl)-6-(propylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 62165513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).