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

C7H6N4S — CID 150465299

IUPAC2-(1,2,4-thiadiazol-5-yl)pyridin-3-amine
SMILESNc1cccnc1-c1ncns1
InChIInChI=1S/C7H6N4S/c8-5-2-1-3-9-6(5)7-10-4-11-12-7/h1-4H,8H2
InChIKeyHQQJVKMWNKJTOA-UHFFFAOYSA-N
MW178.22 g/mol
LogP1.18
Rot. Bonds1

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

2-(1,2,4-thiadiazol-5-yl)pyridin-3-amine (PubChem CID 150465299) has the molecular formula C7H6N4S and a molecular weight of 178.22 g/mol. Its IUPAC name is 2-(1,2,4-thiadiazol-5-yl)pyridin-3-amine.

Molecular Properties

Compound Name2-(1,2,4-thiadiazol-5-yl)pyridin-3-amine
PubChem CID150465299
Molecular FormulaC7H6N4S
Molecular Weight178.22 g/mol
Exact Mass178.03
IUPAC Name2-(1,2,4-thiadiazol-5-yl)pyridin-3-amine
SMILESNc1cccnc1-c1ncns1
InChIInChI=1S/C7H6N4S/c8-5-2-1-3-9-6(5)7-10-4-11-12-7/h1-4H,8H2
InChIKeyHQQJVKMWNKJTOA-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

3-(1,2,4-thiadiazol-5-yl)pyridin-2-amine
CID 143221592
2-(1,2-thiazol-5-yl)pyridin-3-amine
CID 131151005
2-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pyridin-3-amine
CID 65275814
5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine
CID 135397018
2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridin-3-amine
CID 69151554
2-(5-methoxythiophen-2-yl)pyridin-3-amine
CID 130587807
2-(3-pyridin-2-yl-2-pyridinyl)pyridin-3-amine
CID 67060209
2-(furan-3-yl)pyridin-3-amine
CID 67131467
2-(1,2,4-thiadiazol-5-yloxy)aniline
CID 65274530
2-(2H-tetrazol-5-yl)pyridin-3-amine
CID 130862951
3-[2-(2,3-diaminophenyl)-3-pyridinyl]benzene-1,2-diamine
CID 68582766
5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine
CID 116525595

Frequently Asked Questions

What is the IUPAC name of 2-(1,2,4-thiadiazol-5-yl)pyridin-3-amine?
The IUPAC name of 2-(1,2,4-thiadiazol-5-yl)pyridin-3-amine (CID 150465299) is 2-(1,2,4-thiadiazol-5-yl)pyridin-3-amine.
What is the SMILES notation for 2-(1,2,4-thiadiazol-5-yl)pyridin-3-amine?
The canonical SMILES for 2-(1,2,4-thiadiazol-5-yl)pyridin-3-amine is Nc1cccnc1-c1ncns1.
What is the InChIKey of 2-(1,2,4-thiadiazol-5-yl)pyridin-3-amine?
The InChIKey is HQQJVKMWNKJTOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N4S/c8-5-2-1-3-9-6(5)7-10-4-11-12-7/h1-4H,8H2.
What are the key properties of 2-(1,2,4-thiadiazol-5-yl)pyridin-3-amine?
2-(1,2,4-thiadiazol-5-yl)pyridin-3-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 2-(1,2,4-thiadiazol-5-yl)pyridin-3-amine is sourced from PubChem (CID 150465299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).