ethane;2-methylpyrazolo[1,5-b]pyridazine;2-propan-2-ylpyrazolo[1,5-c]pyrimidine

C18H24N6 — CID 144656064

IUPACethane;2-methylpyrazolo[1,5-b]pyridazine;2-propan-2-ylpyrazolo[1,5-c]pyrimidine
SMILESCC.CC(C)c1cc2ccncn2n1.Cc1cc2cccnn2n1
InChIInChI=1S/C9H11N3.C7H7N3.C2H6/c1-7(2)9-5-8-3-4-10-6-12(8)11-9;1-6-5-7-3-2-4-8-10(7)9-6;1-2/h3-7H,1-2H3;2-5H,1H3;1-2H3
InChIKeyJPCYYUKYWJTDLG-UHFFFAOYSA-N
MW324.43 g/mol
LogP3.92
Rot. Bonds1

About ethane;2-methylpyrazolo[1,5-b]pyridazine;2-propan-2-ylpyrazolo[1,5-c]pyrimidine

ethane;2-methylpyrazolo[1,5-b]pyridazine;2-propan-2-ylpyrazolo[1,5-c]pyrimidine (PubChem CID 144656064) has the molecular formula C18H24N6 and a molecular weight of 324.43 g/mol. Its IUPAC name is ethane;2-methylpyrazolo[1,5-b]pyridazine;2-propan-2-ylpyrazolo[1,5-c]pyrimidine.

Molecular Properties

Compound Nameethane;2-methylpyrazolo[1,5-b]pyridazine;2-propan-2-ylpyrazolo[1,5-c]pyrimidine
PubChem CID144656064
Molecular FormulaC18H24N6
Molecular Weight324.43 g/mol
Exact Mass324.21
IUPAC Nameethane;2-methylpyrazolo[1,5-b]pyridazine;2-propan-2-ylpyrazolo[1,5-c]pyrimidine
SMILESCC.CC(C)c1cc2ccncn2n1.Cc1cc2cccnn2n1
InChIInChI=1S/C9H11N3.C7H7N3.C2H6/c1-7(2)9-5-8-3-4-10-6-12(8)11-9;1-6-5-7-3-2-4-8-10(7)9-6;1-2/h3-7H,1-2H3;2-5H,1H3;1-2H3
InChIKeyJPCYYUKYWJTDLG-UHFFFAOYSA-N
XLogP3.92
TPSA60.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

ethane;2-methylpyrazolo[1,5-c]pyrimidine
CID 144655831
6-methyl-2-propan-2-ylpyrazolo[1,5-a]pyridine
CID 170343546
ethane;pyrazolo[1,5-b]pyridazine
CID 91011674
2-propan-2-ylpyrazolo[1,5-a]pyridine;1-propan-2-ylpyrazolo[5,4-b]pyridine
CID 159894927
5,6-dimethylpyrazolo[1,5-a]pyridine;ethane
CID 90867450
5-propan-2-yloxypyrazolo[1,5-a]pyridine
CID 156655958
5-(2-methylpropyl)pyrazolo[1,5-a]pyridine
CID 146215810
2-propan-2-ylpyrazolo[1,5-a]pyrimidine
CID 59747998
N-(2-amino-1-naphthalen-2-ylpropyl)pyrazolo[1,5-b]pyridazine-2-carboxamide
CID 166334030
ethane;3-methylimidazo[1,5-a]pyridine;2-methylpyrazolo[1,5-a]pyridine
CID 144656039
1-pyrazolo[1,5-a]pyridin-5-ylpropane-2-thiol
CID 139409644
ethane;6-methyl-2-propan-2-ylpyrazolo[1,5-a]pyrimidine
CID 168939363

Frequently Asked Questions

What is the IUPAC name of ethane;2-methylpyrazolo[1,5-b]pyridazine;2-propan-2-ylpyrazolo[1,5-c]pyrimidine?
The IUPAC name of ethane;2-methylpyrazolo[1,5-b]pyridazine;2-propan-2-ylpyrazolo[1,5-c]pyrimidine (CID 144656064) is ethane;2-methylpyrazolo[1,5-b]pyridazine;2-propan-2-ylpyrazolo[1,5-c]pyrimidine.
What is the SMILES notation for ethane;2-methylpyrazolo[1,5-b]pyridazine;2-propan-2-ylpyrazolo[1,5-c]pyrimidine?
The canonical SMILES for ethane;2-methylpyrazolo[1,5-b]pyridazine;2-propan-2-ylpyrazolo[1,5-c]pyrimidine is CC.CC(C)c1cc2ccncn2n1.Cc1cc2cccnn2n1.
What is the InChIKey of ethane;2-methylpyrazolo[1,5-b]pyridazine;2-propan-2-ylpyrazolo[1,5-c]pyrimidine?
The InChIKey is JPCYYUKYWJTDLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3.C7H7N3.C2H6/c1-7(2)9-5-8-3-4-10-6-12(8)11-9;1-6-5-7-3-2-4-8-10(7)9-6;1-2/h3-7H,1-2H3;2-5H,1H3;1-2H3.
What are the key properties of ethane;2-methylpyrazolo[1,5-b]pyridazine;2-propan-2-ylpyrazolo[1,5-c]pyrimidine?
ethane;2-methylpyrazolo[1,5-b]pyridazine;2-propan-2-ylpyrazolo[1,5-c]pyrimidine has a molecular weight of 324.43 g/mol, XLogP of 3.92, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methylpyrazolo[1,5-b]pyridazine;2-propan-2-ylpyrazolo[1,5-c]pyrimidine is sourced from PubChem (CID 144656064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).