6-[[3-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]methyl]pyridazin-3-amine

C12H15N5S — CID 146202165

IUPAC6-[[3-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]methyl]pyridazin-3-amine
SMILESCc1nnc(C2CC(Cc3ccc(N)nn3)C2)s1
InChIInChI=1S/C12H15N5S/c1-7-14-17-12(18-7)9-4-8(5-9)6-10-2-3-11(13)16-15-10/h2-3,8-9H,4-6H2,1H3,(H2,13,16)
InChIKeyNUFLZIQCRNTNHL-UHFFFAOYSA-N
MW261.35 g/mol
LogP1.96
Rot. Bonds3

About 6-[[3-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]methyl]pyridazin-3-amine

6-[[3-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]methyl]pyridazin-3-amine (PubChem CID 146202165) has the molecular formula C12H15N5S and a molecular weight of 261.35 g/mol. Its IUPAC name is 6-[[3-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]methyl]pyridazin-3-amine.

Molecular Properties

Compound Name6-[[3-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]methyl]pyridazin-3-amine
PubChem CID146202165
Molecular FormulaC12H15N5S
Molecular Weight261.35 g/mol
Exact Mass261.10
IUPAC Name6-[[3-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]methyl]pyridazin-3-amine
SMILESCc1nnc(C2CC(Cc3ccc(N)nn3)C2)s1
InChIInChI=1S/C12H15N5S/c1-7-14-17-12(18-7)9-4-8(5-9)6-10-2-3-11(13)16-15-10/h2-3,8-9H,4-6H2,1H3,(H2,13,16)
InChIKeyNUFLZIQCRNTNHL-UHFFFAOYSA-N
XLogP1.96
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-[(3-Ethylcyclobutyl)methyl]pyridazin-3-amine
CID 118218204
5-[4-(6-Aminopyridazin-3-yl)butyl]-1,3,4-thiadiazol-2-amine
CID 147726274
5-[4-(6-benzyl-7H-cyclopenta[c]pyridazin-3-yl)butyl]-1,3,4-thiadiazol-2-amine
CID 159314901
5-[4-(7H-cyclopenta[c]pyridazin-3-yl)butyl]-1,3,4-thiadiazol-2-amine
CID 160962196
5-[3-(4-Pyridazin-3-ylcyclohexyl)propyl]-1,3,4-thiadiazol-2-amine
CID 163812955
6-(4-Methylthiophen-3-yl)pyridazin-3-amine
CID 164589792
6-Cyclobutyl-3-pyridazinamine
CID 45787818
6-(5-Ethylthiophen-2-yl)pyridazin-3-amine
CID 62202497
6-(5-Methylthiophen-2-yl)pyridazin-3-amine
CID 62202679
5-Methyl-6-thiophen-2-ylpyridazin-3-amine
CID 62784417
(5-Methyl-6-thiophen-2-ylpyridazin-3-yl)hydrazine
CID 62785357
[6-(3-Methylthiophen-2-yl)pyridazin-3-yl]hydrazine
CID 63990514

Frequently Asked Questions

What is the IUPAC name of 6-[[3-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]methyl]pyridazin-3-amine?
The IUPAC name of 6-[[3-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]methyl]pyridazin-3-amine (CID 146202165) is 6-[[3-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]methyl]pyridazin-3-amine.
What is the SMILES notation for 6-[[3-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]methyl]pyridazin-3-amine?
The canonical SMILES for 6-[[3-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]methyl]pyridazin-3-amine is Cc1nnc(C2CC(Cc3ccc(N)nn3)C2)s1.
What is the InChIKey of 6-[[3-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]methyl]pyridazin-3-amine?
The InChIKey is NUFLZIQCRNTNHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5S/c1-7-14-17-12(18-7)9-4-8(5-9)6-10-2-3-11(13)16-15-10/h2-3,8-9H,4-6H2,1H3,(H2,13,16).
What are the key properties of 6-[[3-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]methyl]pyridazin-3-amine?
6-[[3-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]methyl]pyridazin-3-amine has a molecular weight of 261.35 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[3-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]methyl]pyridazin-3-amine is sourced from PubChem (CID 146202165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).