3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine

C14H17N5OS — CID 75515613

IUPAC3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine
SMILESCOCCc1nsc(NCc2cn3cccc(C)c3n2)n1
InChIInChI=1S/C14H17N5OS/c1-10-4-3-6-19-9-11(16-13(10)19)8-15-14-17-12(18-21-14)5-7-20-2/h3-4,6,9H,5,7-8H2,1-2H3,(H,15,17,18)
InChIKeyIWZCOSHHTHJDTK-UHFFFAOYSA-N
MW303.39 g/mol
LogP2.30
Rot. Bonds6

About 3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine

3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine (PubChem CID 75515613) has the molecular formula C14H17N5OS and a molecular weight of 303.39 g/mol. Its IUPAC name is 3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound Name3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine
PubChem CID75515613
Molecular FormulaC14H17N5OS
Molecular Weight303.39 g/mol
Exact Mass303.12
IUPAC Name3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine
SMILESCOCCc1nsc(NCc2cn3cccc(C)c3n2)n1
InChIInChI=1S/C14H17N5OS/c1-10-4-3-6-19-9-11(16-13(10)19)8-15-14-17-12(18-21-14)5-7-20-2/h3-4,6,9H,5,7-8H2,1-2H3,(H,15,17,18)
InChIKeyIWZCOSHHTHJDTK-UHFFFAOYSA-N
XLogP2.30
TPSA64.34 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.39
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine?
The IUPAC name of 3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine (CID 75515613) is 3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for 3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine?
The canonical SMILES for 3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine is COCCc1nsc(NCc2cn3cccc(C)c3n2)n1.
What is the InChIKey of 3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine?
The InChIKey is IWZCOSHHTHJDTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5OS/c1-10-4-3-6-19-9-11(16-13(10)19)8-15-14-17-12(18-21-14)5-7-20-2/h3-4,6,9H,5,7-8H2,1-2H3,(H,15,17,18).
What are the key properties of 3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine?
3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine has a molecular weight of 303.39 g/mol, XLogP of 2.30, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 75515613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).