3-chloro-5-methylthieno[2,3-c]pyridazin-6-amine

C7H6ClN3S — CID 170350002

IUPAC3-chloro-5-methylthieno[2,3-c]pyridazin-6-amine
SMILESCc1c(N)sc2nnc(Cl)cc12
InChIInChI=1S/C7H6ClN3S/c1-3-4-2-5(8)10-11-7(4)12-6(3)9/h2H,9H2,1H3
InChIKeyNMAZHUFRTOPJTB-UHFFFAOYSA-N
MW199.67 g/mol
LogP2.24
Rot. Bonds

About 3-chloro-5-methylthieno[2,3-c]pyridazin-6-amine

3-chloro-5-methylthieno[2,3-c]pyridazin-6-amine (PubChem CID 170350002) has the molecular formula C7H6ClN3S and a molecular weight of 199.67 g/mol. Its IUPAC name is 3-chloro-5-methylthieno[2,3-c]pyridazin-6-amine.

Molecular Properties

Compound Name3-chloro-5-methylthieno[2,3-c]pyridazin-6-amine
PubChem CID170350002
Molecular FormulaC7H6ClN3S
Molecular Weight199.67 g/mol
Exact Mass199.00
IUPAC Name3-chloro-5-methylthieno[2,3-c]pyridazin-6-amine
SMILESCc1c(N)sc2nnc(Cl)cc12
InChIInChI=1S/C7H6ClN3S/c1-3-4-2-5(8)10-11-7(4)12-6(3)9/h2H,9H2,1H3
InChIKeyNMAZHUFRTOPJTB-UHFFFAOYSA-N
XLogP2.24
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.67
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-methylthieno[2,3-c]pyridazin-6-amine?
The IUPAC name of 3-chloro-5-methylthieno[2,3-c]pyridazin-6-amine (CID 170350002) is 3-chloro-5-methylthieno[2,3-c]pyridazin-6-amine.
What is the SMILES notation for 3-chloro-5-methylthieno[2,3-c]pyridazin-6-amine?
The canonical SMILES for 3-chloro-5-methylthieno[2,3-c]pyridazin-6-amine is Cc1c(N)sc2nnc(Cl)cc12.
What is the InChIKey of 3-chloro-5-methylthieno[2,3-c]pyridazin-6-amine?
The InChIKey is NMAZHUFRTOPJTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClN3S/c1-3-4-2-5(8)10-11-7(4)12-6(3)9/h2H,9H2,1H3.
What are the key properties of 3-chloro-5-methylthieno[2,3-c]pyridazin-6-amine?
3-chloro-5-methylthieno[2,3-c]pyridazin-6-amine has a molecular weight of 199.67 g/mol, XLogP of 2.24, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-methylthieno[2,3-c]pyridazin-6-amine is sourced from PubChem (CID 170350002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).