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

C6H7N5S2 — CID 107648317

IUPAC5-methyl-N-(thiadiazol-4-ylmethyl)-1,3,4-thiadiazol-2-amine
SMILESCc1nnc(NCc2csnn2)s1
InChIInChI=1S/C6H7N5S2/c1-4-8-10-6(13-4)7-2-5-3-12-11-9-5/h3H,2H2,1H3,(H,7,10)
InChIKeyWQIYPMHSVVBOKT-UHFFFAOYSA-N
MW213.29 g/mol
LogP1.31
Rot. Bonds3

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

5-methyl-N-(thiadiazol-4-ylmethyl)-1,3,4-thiadiazol-2-amine (PubChem CID 107648317) has the molecular formula C6H7N5S2 and a molecular weight of 213.29 g/mol. Its IUPAC name is 5-methyl-N-(thiadiazol-4-ylmethyl)-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound Name5-methyl-N-(thiadiazol-4-ylmethyl)-1,3,4-thiadiazol-2-amine
PubChem CID107648317
Molecular FormulaC6H7N5S2
Molecular Weight213.29 g/mol
Exact Mass213.01
IUPAC Name5-methyl-N-(thiadiazol-4-ylmethyl)-1,3,4-thiadiazol-2-amine
SMILESCc1nnc(NCc2csnn2)s1
InChIInChI=1S/C6H7N5S2/c1-4-8-10-6(13-4)7-2-5-3-12-11-9-5/h3H,2H2,1H3,(H,7,10)
InChIKeyWQIYPMHSVVBOKT-UHFFFAOYSA-N
XLogP1.31
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.29
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-methyl-N-[(5-methyl-2-pyridinyl)methyl]-1,3,4-thiadiazol-2-amine
CID 115924977
5-methyl-N-[(1-methyltriazol-4-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 103934107
N-[(6-bromo-2-pyridinyl)methyl]-5-methyl-1,3,4-thiadiazol-2-amine
CID 107648229
5-methyl-N-[(5-methylthiophen-2-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 64982707
5-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 65209607
3,4-dimethyl-N-(thiadiazol-4-ylmethyl)aniline
CID 43663904
N-[(4-fluorophenyl)methyl]-5-methyl-1,3,4-thiadiazol-2-amine
CID 64913971
5-methyl-N-(1,3-thiazol-5-ylmethyl)-1,3,4-thiadiazol-2-amine
CID 115924966
5-methyl-N-(thiophen-3-ylmethyl)-1,3,4-thiadiazol-2-amine
CID 64982615
5-methyl-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 133331350
2-fluoro-3-methyl-N-(thiadiazol-4-ylmethyl)aniline
CID 115904338
5-methyl-N-[(3-methylthiophen-2-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 79003136

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(thiadiazol-4-ylmethyl)-1,3,4-thiadiazol-2-amine?
The IUPAC name of 5-methyl-N-(thiadiazol-4-ylmethyl)-1,3,4-thiadiazol-2-amine (CID 107648317) is 5-methyl-N-(thiadiazol-4-ylmethyl)-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for 5-methyl-N-(thiadiazol-4-ylmethyl)-1,3,4-thiadiazol-2-amine?
The canonical SMILES for 5-methyl-N-(thiadiazol-4-ylmethyl)-1,3,4-thiadiazol-2-amine is Cc1nnc(NCc2csnn2)s1.
What is the InChIKey of 5-methyl-N-(thiadiazol-4-ylmethyl)-1,3,4-thiadiazol-2-amine?
The InChIKey is WQIYPMHSVVBOKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N5S2/c1-4-8-10-6(13-4)7-2-5-3-12-11-9-5/h3H,2H2,1H3,(H,7,10).
What are the key properties of 5-methyl-N-(thiadiazol-4-ylmethyl)-1,3,4-thiadiazol-2-amine?
5-methyl-N-(thiadiazol-4-ylmethyl)-1,3,4-thiadiazol-2-amine has a molecular weight of 213.29 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(thiadiazol-4-ylmethyl)-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 107648317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).