N-ethyl-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazol-5-amine

C9H11N5OS — CID 103375416

IUPACN-ethyl-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazol-5-amine
SMILESCCNc1nc(-c2ccc(OC)nn2)ns1
InChIInChI=1S/C9H11N5OS/c1-3-10-9-11-8(14-16-9)6-4-5-7(15-2)13-12-6/h4-5H,3H2,1-2H3,(H,10,11,14)
InChIKeyUFSFCESITCSTQK-UHFFFAOYSA-N
MW237.29 g/mol
LogP1.44
Rot. Bonds4

About N-ethyl-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazol-5-amine

N-ethyl-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazol-5-amine (PubChem CID 103375416) has the molecular formula C9H11N5OS and a molecular weight of 237.29 g/mol. Its IUPAC name is N-ethyl-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound NameN-ethyl-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazol-5-amine
PubChem CID103375416
Molecular FormulaC9H11N5OS
Molecular Weight237.29 g/mol
Exact Mass237.07
IUPAC NameN-ethyl-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazol-5-amine
SMILESCCNc1nc(-c2ccc(OC)nn2)ns1
InChIInChI=1S/C9H11N5OS/c1-3-10-9-11-8(14-16-9)6-4-5-7(15-2)13-12-6/h4-5H,3H2,1-2H3,(H,10,11,14)
InChIKeyUFSFCESITCSTQK-UHFFFAOYSA-N
XLogP1.44
TPSA72.82 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.29
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-ethyl-3-quinolin-2-yl-1,2,4-thiadiazol-5-amine
CID 65268804
5-bromo-N-ethyl-2-(6-methoxypyridazin-3-yl)pyrimidin-4-amine
CID 103375046
6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine
CID 103375001
2-(6-methoxypyridazin-3-yl)-6-methyl-N-propylpyrimidin-4-amine
CID 103374966
3-[3-(6-methoxypyridazin-3-yl)-1,2,4-oxadiazol-5-yl]pentan-3-amine
CID 103372928
[3-(6-methoxypyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hydrazine
CID 103375154
1-[3-(6-methoxypyridazin-3-yl)-1,2,4-oxadiazol-5-yl]-2-methylpropan-2-amine
CID 103372818
5-bromo-2-(6-methoxypyridazin-3-yl)-6-propylpyrimidin-4-amine
CID 103375014
3-(2-bromo-5-fluorophenyl)-N-ethyl-1,2,4-thiadiazol-5-amine
CID 107924739
N-ethyl-3-(1-methylpyrazol-4-yl)-1,2,4-thiadiazol-5-amine
CID 65269150
6-ethyl-5-iodo-2-(6-methoxypyridazin-3-yl)-N-propylpyrimidin-4-amine
CID 103375031
6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine
CID 103375000

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazol-5-amine?
The IUPAC name of N-ethyl-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazol-5-amine (CID 103375416) is N-ethyl-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for N-ethyl-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazol-5-amine?
The canonical SMILES for N-ethyl-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazol-5-amine is CCNc1nc(-c2ccc(OC)nn2)ns1.
What is the InChIKey of N-ethyl-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazol-5-amine?
The InChIKey is UFSFCESITCSTQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5OS/c1-3-10-9-11-8(14-16-9)6-4-5-7(15-2)13-12-6/h4-5H,3H2,1-2H3,(H,10,11,14).
What are the key properties of N-ethyl-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazol-5-amine?
N-ethyl-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazol-5-amine has a molecular weight of 237.29 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 103375416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).