4-(1,2,5-thiadiazol-3-ylmethyl)-1,3-thiazol-2-amine

C6H6N4S2 — CID 57124146

IUPAC4-(1,2,5-thiadiazol-3-ylmethyl)-1,3-thiazol-2-amine
SMILESNc1nc(Cc2cnsn2)cs1
InChIInChI=1S/C6H6N4S2/c7-6-9-5(3-11-6)1-4-2-8-12-10-4/h2-3H,1H2,(H2,7,9)
InChIKeyWNMJMFPLRBLJCN-UHFFFAOYSA-N
MW198.28 g/mol
LogP1.17
Rot. Bonds2

About 4-(1,2,5-thiadiazol-3-ylmethyl)-1,3-thiazol-2-amine

4-(1,2,5-thiadiazol-3-ylmethyl)-1,3-thiazol-2-amine (PubChem CID 57124146) has the molecular formula C6H6N4S2 and a molecular weight of 198.28 g/mol. Its IUPAC name is 4-(1,2,5-thiadiazol-3-ylmethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(1,2,5-thiadiazol-3-ylmethyl)-1,3-thiazol-2-amine
PubChem CID57124146
Molecular FormulaC6H6N4S2
Molecular Weight198.28 g/mol
Exact Mass198.00
IUPAC Name4-(1,2,5-thiadiazol-3-ylmethyl)-1,3-thiazol-2-amine
SMILESNc1nc(Cc2cnsn2)cs1
InChIInChI=1S/C6H6N4S2/c7-6-9-5(3-11-6)1-4-2-8-12-10-4/h2-3H,1H2,(H2,7,9)
InChIKeyWNMJMFPLRBLJCN-UHFFFAOYSA-N
XLogP1.17
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.28
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-[(2-amino-1,3-thiazol-4-yl)methyl]-1,2,4-oxadiazol-3-amine
CID 65417058
4-(2-fluoroethyl)-1,3-thiazol-2-amine
CID 83854193
ethane;4-propyl-1,3-thiazol-2-amine
CID 155733982
4-[[methyl(propan-2-yl)amino]methyl]-1,3-thiazol-2-amine
CID 21090604
ethane;4-(2-methylpropyl)-1,3-thiazol-2-amine
CID 142312130
5-[(2-amino-1,3-thiazol-4-yl)methyl]-N-methyl-1,3,4-thiadiazol-2-amine
CID 1383638
4-[(2-bromo-4-chlorophenyl)methyl]-1,3-thiazol-2-amine
CID 91597758
acetic acid;tris(4-ethyl-1,3-thiazol-2-amine)
CID 173153334
1-(2-amino-1,3-thiazol-4-yl)propan-2-one
CID 22977217
4-(ethylaminomethyl)-1,3-thiazol-2-amine
CID 61325594
2-(2-amino-1,3-thiazol-4-yl)acetic acid;hydrochloride
CID 13017673
5-[(2-amino-1,3-thiazol-4-yl)methyl]-N,N-dimethyl-1,2,4-oxadiazol-3-amine
CID 116799505

Frequently Asked Questions

What is the IUPAC name of 4-(1,2,5-thiadiazol-3-ylmethyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(1,2,5-thiadiazol-3-ylmethyl)-1,3-thiazol-2-amine (CID 57124146) is 4-(1,2,5-thiadiazol-3-ylmethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(1,2,5-thiadiazol-3-ylmethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(1,2,5-thiadiazol-3-ylmethyl)-1,3-thiazol-2-amine is Nc1nc(Cc2cnsn2)cs1.
What is the InChIKey of 4-(1,2,5-thiadiazol-3-ylmethyl)-1,3-thiazol-2-amine?
The InChIKey is WNMJMFPLRBLJCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4S2/c7-6-9-5(3-11-6)1-4-2-8-12-10-4/h2-3H,1H2,(H2,7,9).
What are the key properties of 4-(1,2,5-thiadiazol-3-ylmethyl)-1,3-thiazol-2-amine?
4-(1,2,5-thiadiazol-3-ylmethyl)-1,3-thiazol-2-amine has a molecular weight of 198.28 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,2,5-thiadiazol-3-ylmethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 57124146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).