6-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-3-amine

C7H5ClN4S — CID 135394856

IUPAC6-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-3-amine
SMILESNc1ccc(-c2nnc(Cl)s2)nc1
InChIInChI=1S/C7H5ClN4S/c8-7-12-11-6(13-7)5-2-1-4(9)3-10-5/h1-3H,9H2
InChIKeyPWSITLJFCDODRW-UHFFFAOYSA-N
MW212.67 g/mol
LogP1.84
Rot. Bonds1

About 6-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-3-amine

6-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-3-amine (PubChem CID 135394856) has the molecular formula C7H5ClN4S and a molecular weight of 212.67 g/mol. Its IUPAC name is 6-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-3-amine.

Molecular Properties

Compound Name6-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-3-amine
PubChem CID135394856
Molecular FormulaC7H5ClN4S
Molecular Weight212.67 g/mol
Exact Mass211.99
IUPAC Name6-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-3-amine
SMILESNc1ccc(-c2nnc(Cl)s2)nc1
InChIInChI=1S/C7H5ClN4S/c8-7-12-11-6(13-7)5-2-1-4(9)3-10-5/h1-3H,9H2
InChIKeyPWSITLJFCDODRW-UHFFFAOYSA-N
XLogP1.84
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.67
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-5-(5-fluoro-2-pyridinyl)-1,3,4-thiadiazole
CID 104643074
6-(5-amino-2-pyridinyl)pyridin-3-amine;dihydrochloride
CID 11557953
5-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-2-amine
CID 135396794
6-[4-(5-amino-2-pyridinyl)phenyl]pyridin-3-amine
CID 25187082
2-(5-chloro-2-pyridinyl)-1,3-benzothiazol-6-amine
CID 66202869
2-chloro-5-(thiadiazol-4-yl)-1,3,4-thiadiazole
CID 65216358
6-[3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]pyridin-3-amine
CID 114352910
6-[6-(5-methyl-2-pyridinyl)-1,2,4,5-tetrazin-3-yl]pyridin-3-amine
CID 178111982
acetic acid;6-(1,3-thiazol-2-yl)pyridin-3-amine
CID 174590691
6-(2-chloro-4-methylphenyl)pyridin-3-amine
CID 144687572
6-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)pyridin-3-amine
CID 146552784
5-(5-amino-2-pyridinyl)thiophene-2-carboxylic acid
CID 58657308

Frequently Asked Questions

What is the IUPAC name of 6-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-3-amine?
The IUPAC name of 6-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-3-amine (CID 135394856) is 6-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-3-amine.
What is the SMILES notation for 6-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-3-amine?
The canonical SMILES for 6-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-3-amine is Nc1ccc(-c2nnc(Cl)s2)nc1.
What is the InChIKey of 6-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-3-amine?
The InChIKey is PWSITLJFCDODRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClN4S/c8-7-12-11-6(13-7)5-2-1-4(9)3-10-5/h1-3H,9H2.
What are the key properties of 6-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-3-amine?
6-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-3-amine has a molecular weight of 212.67 g/mol, XLogP of 1.84, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-chloro-1,3,4-thiadiazol-2-yl)pyridin-3-amine is sourced from PubChem (CID 135394856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).