3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine

C7H6N4S — CID 143221592

IUPAC3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine
SMILESNc1ncccc1-c1ncns1
InChIInChI=1S/C7H6N4S/c8-6-5(2-1-3-9-6)7-10-4-11-12-7/h1-4H,(H2,8,9)
InChIKeyLECJUICYHXXTEB-UHFFFAOYSA-N
MW178.22 g/mol
LogP1.18
Rot. Bonds1

About 3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine

3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine (PubChem CID 143221592) has the molecular formula C7H6N4S and a molecular weight of 178.22 g/mol. Its IUPAC name is 3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine.

Molecular Properties

Compound Name3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine
PubChem CID143221592
Molecular FormulaC7H6N4S
Molecular Weight178.22 g/mol
Exact Mass178.03
IUPAC Name3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine
SMILESNc1ncccc1-c1ncns1
InChIInChI=1S/C7H6N4S/c8-6-5(2-1-3-9-6)7-10-4-11-12-7/h1-4H,(H2,8,9)
InChIKeyLECJUICYHXXTEB-UHFFFAOYSA-N
XLogP1.18
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.22
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1,2,4-thiadiazol-5-yl)pyridin-3-amine
CID 150465299
3-(2-amino-3-pyridinyl)pyridin-2-amine
CID 1236677
3-(2-aminophenyl)pyridin-2-amine
CID 130114605
3-[5-(chloromethyl)-1,3-thiazol-2-yl]pyridin-2-amine;hydrochloride
CID 22019060
5-pyridin-3-yl-1,2,4-thiadiazole
CID 12600754
3-(2,4,5-trifluorophenyl)pyridin-2-amine
CID 115503110
3-(2,4,5-trichlorophenyl)pyridin-2-amine
CID 119020095
2-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pyridin-3-amine
CID 65275814
5-acetyl-2-(2-amino-3-pyridinyl)-1,3-thiazole-4-carboxylic acid
CID 107380209
3-[5-(trifluoromethyl)-1H-imidazol-2-yl]pyridin-2-amine
CID 102970472
3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyridin-2-amine
CID 106783896
3-[4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]pyridin-2-amine
CID 65197444

Frequently Asked Questions

What is the IUPAC name of 3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine?
The IUPAC name of 3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine (CID 143221592) is 3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine.
What is the SMILES notation for 3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine?
The canonical SMILES for 3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine is Nc1ncccc1-c1ncns1.
What is the InChIKey of 3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine?
The InChIKey is LECJUICYHXXTEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N4S/c8-6-5(2-1-3-9-6)7-10-4-11-12-7/h1-4H,(H2,8,9).
What are the key properties of 3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine?
3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine has a molecular weight of 178.22 g/mol, XLogP of 1.18, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine is sourced from PubChem (CID 143221592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).