N-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine

C9H12N6 — CID 78968755

IUPACN-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine
SMILESCC1(C)CC1Nc1ccc2nnnn2n1
InChIInChI=1S/C9H12N6/c1-9(2)5-6(9)10-7-3-4-8-11-13-14-15(8)12-7/h3-4,6H,5H2,1-2H3,(H,10,12)
InChIKeyVOSPANUGFOCVCS-UHFFFAOYSA-N
MW204.24 g/mol
LogP0.73
Rot. Bonds2

About N-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine

N-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine (PubChem CID 78968755) has the molecular formula C9H12N6 and a molecular weight of 204.24 g/mol. Its IUPAC name is N-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine.

Molecular Properties

Compound NameN-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine
PubChem CID78968755
Molecular FormulaC9H12N6
Molecular Weight204.24 g/mol
Exact Mass204.11
IUPAC NameN-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine
SMILESCC1(C)CC1Nc1ccc2nnnn2n1
InChIInChI=1S/C9H12N6/c1-9(2)5-6(9)10-7-3-4-8-11-13-14-15(8)12-7/h3-4,6H,5H2,1-2H3,(H,10,12)
InChIKeyVOSPANUGFOCVCS-UHFFFAOYSA-N
XLogP0.73
TPSA68.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.24
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine?
The IUPAC name of N-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine (CID 78968755) is N-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine.
What is the SMILES notation for N-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine?
The canonical SMILES for N-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine is CC1(C)CC1Nc1ccc2nnnn2n1.
What is the InChIKey of N-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine?
The InChIKey is VOSPANUGFOCVCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N6/c1-9(2)5-6(9)10-7-3-4-8-11-13-14-15(8)12-7/h3-4,6H,5H2,1-2H3,(H,10,12).
What are the key properties of N-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine?
N-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine has a molecular weight of 204.24 g/mol, XLogP of 0.73, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine is sourced from PubChem (CID 78968755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).