3-methyl-7-propan-2-ylthieno[2,3-d]pyridazine

C10H12N2S — CID 88983487

IUPAC3-methyl-7-propan-2-ylthieno[2,3-d]pyridazine
SMILESCc1csc2c(C(C)C)nncc12
InChIInChI=1S/C10H12N2S/c1-6(2)9-10-8(4-11-12-9)7(3)5-13-10/h4-6H,1-3H3
InChIKeyVUKJOLUHVYZUHR-UHFFFAOYSA-N
MW192.29 g/mol
LogP3.12
Rot. Bonds1

About 3-methyl-7-propan-2-ylthieno[2,3-d]pyridazine

3-methyl-7-propan-2-ylthieno[2,3-d]pyridazine (PubChem CID 88983487) has the molecular formula C10H12N2S and a molecular weight of 192.29 g/mol. Its IUPAC name is 3-methyl-7-propan-2-ylthieno[2,3-d]pyridazine.

Molecular Properties

Compound Name3-methyl-7-propan-2-ylthieno[2,3-d]pyridazine
PubChem CID88983487
Molecular FormulaC10H12N2S
Molecular Weight192.29 g/mol
Exact Mass192.07
IUPAC Name3-methyl-7-propan-2-ylthieno[2,3-d]pyridazine
SMILESCc1csc2c(C(C)C)nncc12
InChIInChI=1S/C10H12N2S/c1-6(2)9-10-8(4-11-12-9)7(3)5-13-10/h4-6H,1-3H3
InChIKeyVUKJOLUHVYZUHR-UHFFFAOYSA-N
XLogP3.12
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.29
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-7-propan-2-ylthieno[2,3-d]pyridazine?
The IUPAC name of 3-methyl-7-propan-2-ylthieno[2,3-d]pyridazine (CID 88983487) is 3-methyl-7-propan-2-ylthieno[2,3-d]pyridazine.
What is the SMILES notation for 3-methyl-7-propan-2-ylthieno[2,3-d]pyridazine?
The canonical SMILES for 3-methyl-7-propan-2-ylthieno[2,3-d]pyridazine is Cc1csc2c(C(C)C)nncc12.
What is the InChIKey of 3-methyl-7-propan-2-ylthieno[2,3-d]pyridazine?
The InChIKey is VUKJOLUHVYZUHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2S/c1-6(2)9-10-8(4-11-12-9)7(3)5-13-10/h4-6H,1-3H3.
What are the key properties of 3-methyl-7-propan-2-ylthieno[2,3-d]pyridazine?
3-methyl-7-propan-2-ylthieno[2,3-d]pyridazine has a molecular weight of 192.29 g/mol, XLogP of 3.12, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-7-propan-2-ylthieno[2,3-d]pyridazine is sourced from PubChem (CID 88983487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).