5-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine

C10H8N4OS2 — CID 82427306

IUPAC5-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine
SMILESCc1nc(-c2ccco2)sc1-c1nnc(N)s1
InChIInChI=1S/C10H8N4OS2/c1-5-7(9-13-14-10(11)17-9)16-8(12-5)6-3-2-4-15-6/h2-4H,1H3,(H2,11,14)
InChIKeyBNQHKHJECSLDAC-UHFFFAOYSA-N
MW264.33 g/mol
LogP2.81
Rot. Bonds2

About 5-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine

5-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine (PubChem CID 82427306) has the molecular formula C10H8N4OS2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 5-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound Name5-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine
PubChem CID82427306
Molecular FormulaC10H8N4OS2
Molecular Weight264.33 g/mol
Exact Mass264.01
IUPAC Name5-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine
SMILESCc1nc(-c2ccco2)sc1-c1nnc(N)s1
InChIInChI=1S/C10H8N4OS2/c1-5-7(9-13-14-10(11)17-9)16-8(12-5)6-3-2-4-15-6/h2-4H,1H3,(H2,11,14)
InChIKeyBNQHKHJECSLDAC-UHFFFAOYSA-N
XLogP2.81
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-bromo-2-(furan-2-yl)-4-methyl-1,3-thiazole
CID 82130320
2-(furan-2-yl)-4-methyl-1,3-thiazole-5-carbonitrile
CID 82427290
5-(bromomethyl)-2-(furan-2-yl)-4-methyl-1,3-thiazole
CID 82427297
1-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine
CID 62699846
5-[4-methyl-2-(4-methylpiperidin-1-yl)-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine
CID 82427932
2-bromo-5-(furan-2-yl)-1,3,4-thiadiazole
CID 63383548
4-[2-(furan-2-yl)-4-propan-2-yl-1,3-thiazol-5-yl]-N-methyl-1,3-thiazol-2-amine
CID 82435110
1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine
CID 64718148
1-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-2-methylbutan-1-one
CID 170582471
2-(furan-2-yl)-N-(2-methoxyethoxy)-5-methyl-1,3-thiazole-4-carboxamide
CID 79676397
5-(furan-2-yl)-4-methyl-1,3-thiazole-2-carboxylic acid
CID 82126671
5-[2-(2-methoxyethyl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine
CID 82425677

Frequently Asked Questions

What is the IUPAC name of 5-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine?
The IUPAC name of 5-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine (CID 82427306) is 5-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for 5-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine?
The canonical SMILES for 5-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine is Cc1nc(-c2ccco2)sc1-c1nnc(N)s1.
What is the InChIKey of 5-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine?
The InChIKey is BNQHKHJECSLDAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4OS2/c1-5-7(9-13-14-10(11)17-9)16-8(12-5)6-3-2-4-15-6/h2-4H,1H3,(H2,11,14).
What are the key properties of 5-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine?
5-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine has a molecular weight of 264.33 g/mol, XLogP of 2.81, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 82427306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).