6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide

C15H24N4O — CID 103968311

IUPAC6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide
SMILESCC1(C)CC(NC(=O)c2ccc(N)nn2)CC(C)(C)C1
InChIInChI=1S/C15H24N4O/c1-14(2)7-10(8-15(3,4)9-14)17-13(20)11-5-6-12(16)19-18-11/h5-6,10H,7-9H2,1-4H3,(H2,16,19)(H,17,20)
InChIKeyXVGIQLDGRIDIER-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.39
Rot. Bonds2

About 6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide

6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide (PubChem CID 103968311) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide
PubChem CID103968311
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide
SMILESCC1(C)CC(NC(=O)c2ccc(N)nn2)CC(C)(C)C1
InChIInChI=1S/C15H24N4O/c1-14(2)7-10(8-15(3,4)9-14)17-13(20)11-5-6-12(16)19-18-11/h5-6,10H,7-9H2,1-4H3,(H2,16,19)(H,17,20)
InChIKeyXVGIQLDGRIDIER-UHFFFAOYSA-N
XLogP2.39
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide?
The IUPAC name of 6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide (CID 103968311) is 6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide is CC1(C)CC(NC(=O)c2ccc(N)nn2)CC(C)(C)C1.
What is the InChIKey of 6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide?
The InChIKey is XVGIQLDGRIDIER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-14(2)7-10(8-15(3,4)9-14)17-13(20)11-5-6-12(16)19-18-11/h5-6,10H,7-9H2,1-4H3,(H2,16,19)(H,17,20).
What are the key properties of 6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide?
6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.39, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide is sourced from PubChem (CID 103968311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).