ethane;pyridazin-3-amine

C6H11N3 — CID 123792295

IUPACethane;pyridazin-3-amine
SMILESCC.Nc1cccnn1
InChIInChI=1S/C4H5N3.C2H6/c5-4-2-1-3-6-7-4;1-2/h1-3H,(H2,5,7);1-2H3
InChIKeyFBZRDAQSEXDFGR-UHFFFAOYSA-N
MW125.17 g/mol
LogP1.09
Rot. Bonds

About ethane;pyridazin-3-amine

ethane;pyridazin-3-amine (PubChem CID 123792295) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is ethane;pyridazin-3-amine.

Molecular Properties

Compound Nameethane;pyridazin-3-amine
PubChem CID123792295
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Nameethane;pyridazin-3-amine
SMILESCC.Nc1cccnn1
InChIInChI=1S/C4H5N3.C2H6/c5-4-2-1-3-6-7-4;1-2/h1-3H,(H2,5,7);1-2H3
InChIKeyFBZRDAQSEXDFGR-UHFFFAOYSA-N
XLogP1.09
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;pyridazin-3-amine?
The IUPAC name of ethane;pyridazin-3-amine (CID 123792295) is ethane;pyridazin-3-amine.
What is the SMILES notation for ethane;pyridazin-3-amine?
The canonical SMILES for ethane;pyridazin-3-amine is CC.Nc1cccnn1.
What is the InChIKey of ethane;pyridazin-3-amine?
The InChIKey is FBZRDAQSEXDFGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5N3.C2H6/c5-4-2-1-3-6-7-4;1-2/h1-3H,(H2,5,7);1-2H3.
What are the key properties of ethane;pyridazin-3-amine?
ethane;pyridazin-3-amine has a molecular weight of 125.17 g/mol, XLogP of 1.09, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;pyridazin-3-amine is sourced from PubChem (CID 123792295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).