3-fluoro-2-methylthieno[2,3-d]pyridazin-4-amine

C7H6FN3S — CID 178061273

IUPAC3-fluoro-2-methylthieno[2,3-d]pyridazin-4-amine
SMILESCc1sc2cnnc(N)c2c1F
InChIInChI=1S/C7H6FN3S/c1-3-6(8)5-4(12-3)2-10-11-7(5)9/h2H,1H3,(H2,9,11)
InChIKeyZXQJKZYMQXMRNI-UHFFFAOYSA-N
MW183.21 g/mol
LogP1.72
Rot. Bonds

About 3-fluoro-2-methylthieno[2,3-d]pyridazin-4-amine

3-fluoro-2-methylthieno[2,3-d]pyridazin-4-amine (PubChem CID 178061273) has the molecular formula C7H6FN3S and a molecular weight of 183.21 g/mol. Its IUPAC name is 3-fluoro-2-methylthieno[2,3-d]pyridazin-4-amine.

Molecular Properties

Compound Name3-fluoro-2-methylthieno[2,3-d]pyridazin-4-amine
PubChem CID178061273
Molecular FormulaC7H6FN3S
Molecular Weight183.21 g/mol
Exact Mass183.03
IUPAC Name3-fluoro-2-methylthieno[2,3-d]pyridazin-4-amine
SMILESCc1sc2cnnc(N)c2c1F
InChIInChI=1S/C7H6FN3S/c1-3-6(8)5-4(12-3)2-10-11-7(5)9/h2H,1H3,(H2,9,11)
InChIKeyZXQJKZYMQXMRNI-UHFFFAOYSA-N
XLogP1.72
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-methylthieno[2,3-d]pyridazin-4-amine?
The IUPAC name of 3-fluoro-2-methylthieno[2,3-d]pyridazin-4-amine (CID 178061273) is 3-fluoro-2-methylthieno[2,3-d]pyridazin-4-amine.
What is the SMILES notation for 3-fluoro-2-methylthieno[2,3-d]pyridazin-4-amine?
The canonical SMILES for 3-fluoro-2-methylthieno[2,3-d]pyridazin-4-amine is Cc1sc2cnnc(N)c2c1F.
What is the InChIKey of 3-fluoro-2-methylthieno[2,3-d]pyridazin-4-amine?
The InChIKey is ZXQJKZYMQXMRNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6FN3S/c1-3-6(8)5-4(12-3)2-10-11-7(5)9/h2H,1H3,(H2,9,11).
What are the key properties of 3-fluoro-2-methylthieno[2,3-d]pyridazin-4-amine?
3-fluoro-2-methylthieno[2,3-d]pyridazin-4-amine has a molecular weight of 183.21 g/mol, XLogP of 1.72, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-methylthieno[2,3-d]pyridazin-4-amine is sourced from PubChem (CID 178061273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).