N-tert-butyl-6-(methylamino)pyridazine-3-carboxamide

C10H16N4O — CID 62173045

IUPACN-tert-butyl-6-(methylamino)pyridazine-3-carboxamide
SMILESCNc1ccc(C(=O)NC(C)(C)C)nn1
InChIInChI=1S/C10H16N4O/c1-10(2,3)12-9(15)7-5-6-8(11-4)14-13-7/h5-6H,1-4H3,(H,11,14)(H,12,15)
InChIKeyIEGNHRXGUIJAOO-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.05
Rot. Bonds2

About N-tert-butyl-6-(methylamino)pyridazine-3-carboxamide

N-tert-butyl-6-(methylamino)pyridazine-3-carboxamide (PubChem CID 62173045) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is N-tert-butyl-6-(methylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-6-(methylamino)pyridazine-3-carboxamide
PubChem CID62173045
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC NameN-tert-butyl-6-(methylamino)pyridazine-3-carboxamide
SMILESCNc1ccc(C(=O)NC(C)(C)C)nn1
InChIInChI=1S/C10H16N4O/c1-10(2,3)12-9(15)7-5-6-8(11-4)14-13-7/h5-6H,1-4H3,(H,11,14)(H,12,15)
InChIKeyIEGNHRXGUIJAOO-UHFFFAOYSA-N
XLogP1.05
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-6-(methylamino)pyridazine-3-carboxamide?
The IUPAC name of N-tert-butyl-6-(methylamino)pyridazine-3-carboxamide (CID 62173045) is N-tert-butyl-6-(methylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N-tert-butyl-6-(methylamino)pyridazine-3-carboxamide?
The canonical SMILES for N-tert-butyl-6-(methylamino)pyridazine-3-carboxamide is CNc1ccc(C(=O)NC(C)(C)C)nn1.
What is the InChIKey of N-tert-butyl-6-(methylamino)pyridazine-3-carboxamide?
The InChIKey is IEGNHRXGUIJAOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-10(2,3)12-9(15)7-5-6-8(11-4)14-13-7/h5-6H,1-4H3,(H,11,14)(H,12,15).
What are the key properties of N-tert-butyl-6-(methylamino)pyridazine-3-carboxamide?
N-tert-butyl-6-(methylamino)pyridazine-3-carboxamide has a molecular weight of 208.26 g/mol, XLogP of 1.05, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-6-(methylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 62173045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).