6-N-tert-butyl-3-N,3-N-dimethylpyridazine-3,6-diamine

C10H18N4 — CID 138648265

IUPAC6-N-tert-butyl-3-N,3-N-dimethylpyridazine-3,6-diamine
SMILESCN(C)c1ccc(NC(C)(C)C)nn1
InChIInChI=1S/C10H18N4/c1-10(2,3)11-8-6-7-9(13-12-8)14(4)5/h6-7H,1-5H3,(H,11,12)
InChIKeyVOVJTJFLWMEUIZ-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.75
Rot. Bonds2

About 6-N-tert-butyl-3-N,3-N-dimethylpyridazine-3,6-diamine

6-N-tert-butyl-3-N,3-N-dimethylpyridazine-3,6-diamine (PubChem CID 138648265) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 6-N-tert-butyl-3-N,3-N-dimethylpyridazine-3,6-diamine.

Molecular Properties

Compound Name6-N-tert-butyl-3-N,3-N-dimethylpyridazine-3,6-diamine
PubChem CID138648265
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name6-N-tert-butyl-3-N,3-N-dimethylpyridazine-3,6-diamine
SMILESCN(C)c1ccc(NC(C)(C)C)nn1
InChIInChI=1S/C10H18N4/c1-10(2,3)11-8-6-7-9(13-12-8)14(4)5/h6-7H,1-5H3,(H,11,12)
InChIKeyVOVJTJFLWMEUIZ-UHFFFAOYSA-N
XLogP1.75
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-N-tert-butyl-3-N,3-N-dimethylpyridazine-3,6-diamine?
The IUPAC name of 6-N-tert-butyl-3-N,3-N-dimethylpyridazine-3,6-diamine (CID 138648265) is 6-N-tert-butyl-3-N,3-N-dimethylpyridazine-3,6-diamine.
What is the SMILES notation for 6-N-tert-butyl-3-N,3-N-dimethylpyridazine-3,6-diamine?
The canonical SMILES for 6-N-tert-butyl-3-N,3-N-dimethylpyridazine-3,6-diamine is CN(C)c1ccc(NC(C)(C)C)nn1.
What is the InChIKey of 6-N-tert-butyl-3-N,3-N-dimethylpyridazine-3,6-diamine?
The InChIKey is VOVJTJFLWMEUIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-10(2,3)11-8-6-7-9(13-12-8)14(4)5/h6-7H,1-5H3,(H,11,12).
What are the key properties of 6-N-tert-butyl-3-N,3-N-dimethylpyridazine-3,6-diamine?
6-N-tert-butyl-3-N,3-N-dimethylpyridazine-3,6-diamine has a molecular weight of 194.28 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-tert-butyl-3-N,3-N-dimethylpyridazine-3,6-diamine is sourced from PubChem (CID 138648265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).