N-(2-ethylcyclohexyl)-N-methyltetrazolo[1,5-b]pyridazin-6-amine

C13H20N6 — CID 71853941

IUPACN-(2-ethylcyclohexyl)-N-methyltetrazolo[1,5-b]pyridazin-6-amine
SMILESCCC1CCCCC1N(C)c1ccc2nnnn2n1
InChIInChI=1S/C13H20N6/c1-3-10-6-4-5-7-11(10)18(2)13-9-8-12-14-16-17-19(12)15-13/h8-11H,3-7H2,1-2H3
InChIKeyQIYAXDOUALRFQO-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.92
Rot. Bonds3

About N-(2-ethylcyclohexyl)-N-methyltetrazolo[1,5-b]pyridazin-6-amine

N-(2-ethylcyclohexyl)-N-methyltetrazolo[1,5-b]pyridazin-6-amine (PubChem CID 71853941) has the molecular formula C13H20N6 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-(2-ethylcyclohexyl)-N-methyltetrazolo[1,5-b]pyridazin-6-amine.

Molecular Properties

Compound NameN-(2-ethylcyclohexyl)-N-methyltetrazolo[1,5-b]pyridazin-6-amine
PubChem CID71853941
Molecular FormulaC13H20N6
Molecular Weight260.34 g/mol
Exact Mass260.17
IUPAC NameN-(2-ethylcyclohexyl)-N-methyltetrazolo[1,5-b]pyridazin-6-amine
SMILESCCC1CCCCC1N(C)c1ccc2nnnn2n1
InChIInChI=1S/C13H20N6/c1-3-10-6-4-5-7-11(10)18(2)13-9-8-12-14-16-17-19(12)15-13/h8-11H,3-7H2,1-2H3
InChIKeyQIYAXDOUALRFQO-UHFFFAOYSA-N
XLogP1.92
TPSA59.21 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethylcyclohexyl)-N-methyltetrazolo[1,5-b]pyridazin-6-amine?
The IUPAC name of N-(2-ethylcyclohexyl)-N-methyltetrazolo[1,5-b]pyridazin-6-amine (CID 71853941) is N-(2-ethylcyclohexyl)-N-methyltetrazolo[1,5-b]pyridazin-6-amine.
What is the SMILES notation for N-(2-ethylcyclohexyl)-N-methyltetrazolo[1,5-b]pyridazin-6-amine?
The canonical SMILES for N-(2-ethylcyclohexyl)-N-methyltetrazolo[1,5-b]pyridazin-6-amine is CCC1CCCCC1N(C)c1ccc2nnnn2n1.
What is the InChIKey of N-(2-ethylcyclohexyl)-N-methyltetrazolo[1,5-b]pyridazin-6-amine?
The InChIKey is QIYAXDOUALRFQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N6/c1-3-10-6-4-5-7-11(10)18(2)13-9-8-12-14-16-17-19(12)15-13/h8-11H,3-7H2,1-2H3.
What are the key properties of N-(2-ethylcyclohexyl)-N-methyltetrazolo[1,5-b]pyridazin-6-amine?
N-(2-ethylcyclohexyl)-N-methyltetrazolo[1,5-b]pyridazin-6-amine has a molecular weight of 260.34 g/mol, XLogP of 1.92, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylcyclohexyl)-N-methyltetrazolo[1,5-b]pyridazin-6-amine is sourced from PubChem (CID 71853941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).