N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine

C12H17N7 — CID 127441909

IUPACN-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine
SMILESCC1CC(Nc2ccc3nnnn3n2)CN1C1CC1
InChIInChI=1S/C12H17N7/c1-8-6-9(7-18(8)10-2-3-10)13-11-4-5-12-14-16-17-19(12)15-11/h4-5,8-10H,2-3,6-7H2,1H3,(H,13,15)
InChIKeyVZCWSFCOXDHHHI-UHFFFAOYSA-N
MW259.32 g/mol
LogP0.56
Rot. Bonds3

About N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine

N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine (PubChem CID 127441909) has the molecular formula C12H17N7 and a molecular weight of 259.32 g/mol. Its IUPAC name is N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine.

Molecular Properties

Compound NameN-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine
PubChem CID127441909
Molecular FormulaC12H17N7
Molecular Weight259.32 g/mol
Exact Mass259.15
IUPAC NameN-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine
SMILESCC1CC(Nc2ccc3nnnn3n2)CN1C1CC1
InChIInChI=1S/C12H17N7/c1-8-6-9(7-18(8)10-2-3-10)13-11-4-5-12-14-16-17-19(12)15-11/h4-5,8-10H,2-3,6-7H2,1H3,(H,13,15)
InChIKeyVZCWSFCOXDHHHI-UHFFFAOYSA-N
XLogP0.56
TPSA71.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.32
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine?
The IUPAC name of N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine (CID 127441909) is N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine.
What is the SMILES notation for N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine?
The canonical SMILES for N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine is CC1CC(Nc2ccc3nnnn3n2)CN1C1CC1.
What is the InChIKey of N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine?
The InChIKey is VZCWSFCOXDHHHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N7/c1-8-6-9(7-18(8)10-2-3-10)13-11-4-5-12-14-16-17-19(12)15-11/h4-5,8-10H,2-3,6-7H2,1H3,(H,13,15).
What are the key properties of N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine?
N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine has a molecular weight of 259.32 g/mol, XLogP of 0.56, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine is sourced from PubChem (CID 127441909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).