1,6-di(propan-2-yl)pyrazolo[4,3-c]pyridazine

C11H16N4 — CID 176646226

IUPAC1,6-di(propan-2-yl)pyrazolo[4,3-c]pyridazine
SMILESCC(C)c1cc2c(cnn2C(C)C)nn1
InChIInChI=1S/C11H16N4/c1-7(2)9-5-11-10(14-13-9)6-12-15(11)8(3)4/h5-8H,1-4H3
InChIKeyUTQFEPILKPDOGO-UHFFFAOYSA-N
MW204.28 g/mol
LogP2.53
Rot. Bonds2

About 1,6-di(propan-2-yl)pyrazolo[4,3-c]pyridazine

1,6-di(propan-2-yl)pyrazolo[4,3-c]pyridazine (PubChem CID 176646226) has the molecular formula C11H16N4 and a molecular weight of 204.28 g/mol. Its IUPAC name is 1,6-di(propan-2-yl)pyrazolo[4,3-c]pyridazine.

Molecular Properties

Compound Name1,6-di(propan-2-yl)pyrazolo[4,3-c]pyridazine
PubChem CID176646226
Molecular FormulaC11H16N4
Molecular Weight204.28 g/mol
Exact Mass204.14
IUPAC Name1,6-di(propan-2-yl)pyrazolo[4,3-c]pyridazine
SMILESCC(C)c1cc2c(cnn2C(C)C)nn1
InChIInChI=1S/C11H16N4/c1-7(2)9-5-11-10(14-13-9)6-12-15(11)8(3)4/h5-8H,1-4H3
InChIKeyUTQFEPILKPDOGO-UHFFFAOYSA-N
XLogP2.53
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.28
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1,5-di(propan-2-yl)triazole
CID 161103432
5-chloro-1,4-di(propan-2-yl)pyrazole
CID 90145823
3,4,6-tri(propan-2-yl)pyridazine
CID 58164838
5-chloro-1-propan-2-ylpyrazolo[3,4-c]pyridine
CID 176811583
ethane;6-methyl-1-propan-2-ylpyrazolo[4,5-c]pyridine
CID 142338183
5-ethyl-1,4-di(propan-2-yl)pyrazole
CID 146648119
5,6-dimethyl-1-propan-2-ylbenzotriazole
CID 59167826
5-chloro-1,3-di(propan-2-yl)pyrazole
CID 66020569
1-propan-2-ylpyrazolo[5,4-c]pyridine
CID 122471541
5,6-dichloro-1-propan-2-ylbenzotriazole
CID 178059021
[1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridin-4-yl]-piperidin-1-ylmethanone
CID 24539678
N-methyl-1-propan-2-ylindazol-5-amine
CID 89371360

Frequently Asked Questions

What is the IUPAC name of 1,6-di(propan-2-yl)pyrazolo[4,3-c]pyridazine?
The IUPAC name of 1,6-di(propan-2-yl)pyrazolo[4,3-c]pyridazine (CID 176646226) is 1,6-di(propan-2-yl)pyrazolo[4,3-c]pyridazine.
What is the SMILES notation for 1,6-di(propan-2-yl)pyrazolo[4,3-c]pyridazine?
The canonical SMILES for 1,6-di(propan-2-yl)pyrazolo[4,3-c]pyridazine is CC(C)c1cc2c(cnn2C(C)C)nn1.
What is the InChIKey of 1,6-di(propan-2-yl)pyrazolo[4,3-c]pyridazine?
The InChIKey is UTQFEPILKPDOGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4/c1-7(2)9-5-11-10(14-13-9)6-12-15(11)8(3)4/h5-8H,1-4H3.
What are the key properties of 1,6-di(propan-2-yl)pyrazolo[4,3-c]pyridazine?
1,6-di(propan-2-yl)pyrazolo[4,3-c]pyridazine has a molecular weight of 204.28 g/mol, XLogP of 2.53, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-di(propan-2-yl)pyrazolo[4,3-c]pyridazine is sourced from PubChem (CID 176646226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).