N-methyl-N-(piperidin-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine

C11H17N7 — CID 106642634

IUPACN-methyl-N-(piperidin-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine
SMILESCN(CC1CCCNC1)c1ccc2nnnn2n1
InChIInChI=1S/C11H17N7/c1-17(8-9-3-2-6-12-7-9)11-5-4-10-13-15-16-18(10)14-11/h4-5,9,12H,2-3,6-8H2,1H3
InChIKeyVZFXKDCAGAMGEA-UHFFFAOYSA-N
MW247.31 g/mol
LogP-0.04
Rot. Bonds3

About N-methyl-N-(piperidin-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine

N-methyl-N-(piperidin-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine (PubChem CID 106642634) has the molecular formula C11H17N7 and a molecular weight of 247.31 g/mol. Its IUPAC name is N-methyl-N-(piperidin-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine.

Molecular Properties

Compound NameN-methyl-N-(piperidin-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine
PubChem CID106642634
Molecular FormulaC11H17N7
Molecular Weight247.31 g/mol
Exact Mass247.15
IUPAC NameN-methyl-N-(piperidin-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine
SMILESCN(CC1CCCNC1)c1ccc2nnnn2n1
InChIInChI=1S/C11H17N7/c1-17(8-9-3-2-6-12-7-9)11-5-4-10-13-15-16-18(10)14-11/h4-5,9,12H,2-3,6-8H2,1H3
InChIKeyVZFXKDCAGAMGEA-UHFFFAOYSA-N
XLogP-0.04
TPSA71.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.31
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 106642913
N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine
CID 106618801
N-methyl-N-(piperidin-3-ylmethyl)pyridin-2-amine;hydrochloride
CID 71642131
N-cyclohexyl-N-methyltetrazolo[1,5-b]pyridazin-6-amine
CID 18129399
N,6-dimethyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridazin-3-amine
CID 97164558
N,5-dimethyl-N-(piperidin-3-ylmethyl)pyrimidin-2-amine
CID 106642612
N-methyl-N-(piperidin-3-ylmethyl)pyrazin-2-amine;hydrochloride
CID 71642141
N-methyl-5-nitro-N-(piperidin-3-ylmethyl)pyridin-2-amine
CID 71642116
6-[methyl(piperidin-3-ylmethyl)amino]pyridine-3-sulfonamide
CID 106642822
6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine
CID 97164559
N,1-dimethyl-N-(piperidin-3-ylmethyl)imidazol-2-amine
CID 106642829
6-chloro-N-methyl-N-[[(3R)-piperidin-3-yl]methyl]pyrimidin-4-amine
CID 97164469

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(piperidin-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine?
The IUPAC name of N-methyl-N-(piperidin-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine (CID 106642634) is N-methyl-N-(piperidin-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine.
What is the SMILES notation for N-methyl-N-(piperidin-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine?
The canonical SMILES for N-methyl-N-(piperidin-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine is CN(CC1CCCNC1)c1ccc2nnnn2n1.
What is the InChIKey of N-methyl-N-(piperidin-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine?
The InChIKey is VZFXKDCAGAMGEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N7/c1-17(8-9-3-2-6-12-7-9)11-5-4-10-13-15-16-18(10)14-11/h4-5,9,12H,2-3,6-8H2,1H3.
What are the key properties of N-methyl-N-(piperidin-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine?
N-methyl-N-(piperidin-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine has a molecular weight of 247.31 g/mol, XLogP of -0.04, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(piperidin-3-ylmethyl)tetrazolo[1,5-b]pyridazin-6-amine is sourced from PubChem (CID 106642634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).