5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine

C14H20N4 — CID 67966573

IUPAC5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine
SMILESCc1cnn2nccc2c1NC1CCCCC1C
InChIInChI=1S/C14H20N4/c1-10-5-3-4-6-12(10)17-14-11(2)9-16-18-13(14)7-8-15-18/h7-10,12,17H,3-6H2,1-2H3
InChIKeyXKQOMRLCNNKQHK-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.03
Rot. Bonds2

About 5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine

5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine (PubChem CID 67966573) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine.

Molecular Properties

Compound Name5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine
PubChem CID67966573
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine
SMILESCc1cnn2nccc2c1NC1CCCCC1C
InChIInChI=1S/C14H20N4/c1-10-5-3-4-6-12(10)17-14-11(2)9-16-18-13(14)7-8-15-18/h7-10,12,17H,3-6H2,1-2H3
InChIKeyXKQOMRLCNNKQHK-UHFFFAOYSA-N
XLogP3.03
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine?
The IUPAC name of 5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine (CID 67966573) is 5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine.
What is the SMILES notation for 5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine?
The canonical SMILES for 5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine is Cc1cnn2nccc2c1NC1CCCCC1C.
What is the InChIKey of 5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine?
The InChIKey is XKQOMRLCNNKQHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-10-5-3-4-6-12(10)17-14-11(2)9-16-18-13(14)7-8-15-18/h7-10,12,17H,3-6H2,1-2H3.
What are the key properties of 5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine?
5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine has a molecular weight of 244.34 g/mol, XLogP of 3.03, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-methylcyclohexyl)pyrazolo[1,5-b]pyridazin-4-amine is sourced from PubChem (CID 67966573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).