ethane;2-methylthieno[2,3-d]pyridazin-4-amine

C9H13N3S — CID 178061037

IUPACethane;2-methylthieno[2,3-d]pyridazin-4-amine
SMILESCC.Cc1cc2c(N)nncc2s1
InChIInChI=1S/C7H7N3S.C2H6/c1-4-2-5-6(11-4)3-9-10-7(5)8;1-2/h2-3H,1H3,(H2,8,10);1-2H3
InChIKeyHGQWFEAXZZMXQJ-UHFFFAOYSA-N
MW195.29 g/mol
LogP2.61
Rot. Bonds

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

ethane;2-methylthieno[2,3-d]pyridazin-4-amine (PubChem CID 178061037) has the molecular formula C9H13N3S and a molecular weight of 195.29 g/mol. Its IUPAC name is ethane;2-methylthieno[2,3-d]pyridazin-4-amine.

Molecular Properties

Compound Nameethane;2-methylthieno[2,3-d]pyridazin-4-amine
PubChem CID178061037
Molecular FormulaC9H13N3S
Molecular Weight195.29 g/mol
Exact Mass195.08
IUPAC Nameethane;2-methylthieno[2,3-d]pyridazin-4-amine
SMILESCC.Cc1cc2c(N)nncc2s1
InChIInChI=1S/C7H7N3S.C2H6/c1-4-2-5-6(11-4)3-9-10-7(5)8;1-2/h2-3H,1H3,(H2,8,10);1-2H3
InChIKeyHGQWFEAXZZMXQJ-UHFFFAOYSA-N
XLogP2.61
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.29
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethane;2-methylthieno[2,3-d]pyridazin-4-amine?
The IUPAC name of ethane;2-methylthieno[2,3-d]pyridazin-4-amine (CID 178061037) is ethane;2-methylthieno[2,3-d]pyridazin-4-amine.
What is the SMILES notation for ethane;2-methylthieno[2,3-d]pyridazin-4-amine?
The canonical SMILES for ethane;2-methylthieno[2,3-d]pyridazin-4-amine is CC.Cc1cc2c(N)nncc2s1.
What is the InChIKey of ethane;2-methylthieno[2,3-d]pyridazin-4-amine?
The InChIKey is HGQWFEAXZZMXQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3S.C2H6/c1-4-2-5-6(11-4)3-9-10-7(5)8;1-2/h2-3H,1H3,(H2,8,10);1-2H3.
What are the key properties of ethane;2-methylthieno[2,3-d]pyridazin-4-amine?
ethane;2-methylthieno[2,3-d]pyridazin-4-amine has a molecular weight of 195.29 g/mol, XLogP of 2.61, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methylthieno[2,3-d]pyridazin-4-amine is sourced from PubChem (CID 178061037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).