5-methyl-6-thiophen-2-ylpyridazin-3-amine

C9H9N3S — CID 62784417

IUPAC5-methyl-6-thiophen-2-ylpyridazin-3-amine
SMILESCc1cc(N)nnc1-c1cccs1
InChIInChI=1S/C9H9N3S/c1-6-5-8(10)11-12-9(6)7-3-2-4-13-7/h2-5H,1H3,(H2,10,11)
InChIKeyZEEGDYFIWXOXJV-UHFFFAOYSA-N
MW191.26 g/mol
LogP2.10
Rot. Bonds1

About 5-methyl-6-thiophen-2-ylpyridazin-3-amine

5-methyl-6-thiophen-2-ylpyridazin-3-amine (PubChem CID 62784417) has the molecular formula C9H9N3S and a molecular weight of 191.26 g/mol. Its IUPAC name is 5-methyl-6-thiophen-2-ylpyridazin-3-amine.

Molecular Properties

Compound Name5-methyl-6-thiophen-2-ylpyridazin-3-amine
PubChem CID62784417
Molecular FormulaC9H9N3S
Molecular Weight191.26 g/mol
Exact Mass191.05
IUPAC Name5-methyl-6-thiophen-2-ylpyridazin-3-amine
SMILESCc1cc(N)nnc1-c1cccs1
InChIInChI=1S/C9H9N3S/c1-6-5-8(10)11-12-9(6)7-3-2-4-13-7/h2-5H,1H3,(H2,10,11)
InChIKeyZEEGDYFIWXOXJV-UHFFFAOYSA-N
XLogP2.10
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.26
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-thiophen-2-ylpyridazin-3-amine?
The IUPAC name of 5-methyl-6-thiophen-2-ylpyridazin-3-amine (CID 62784417) is 5-methyl-6-thiophen-2-ylpyridazin-3-amine.
What is the SMILES notation for 5-methyl-6-thiophen-2-ylpyridazin-3-amine?
The canonical SMILES for 5-methyl-6-thiophen-2-ylpyridazin-3-amine is Cc1cc(N)nnc1-c1cccs1.
What is the InChIKey of 5-methyl-6-thiophen-2-ylpyridazin-3-amine?
The InChIKey is ZEEGDYFIWXOXJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3S/c1-6-5-8(10)11-12-9(6)7-3-2-4-13-7/h2-5H,1H3,(H2,10,11).
What are the key properties of 5-methyl-6-thiophen-2-ylpyridazin-3-amine?
5-methyl-6-thiophen-2-ylpyridazin-3-amine has a molecular weight of 191.26 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-thiophen-2-ylpyridazin-3-amine is sourced from PubChem (CID 62784417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).