N-methyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide

C6H9N3OS — CID 11030280

IUPACN-methyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide
SMILESCNC(=O)Cc1nc(C)ns1
InChIInChI=1S/C6H9N3OS/c1-4-8-6(11-9-4)3-5(10)7-2/h3H2,1-2H3,(H,7,10)
InChIKeyMOYUUZYJWZAUMN-UHFFFAOYSA-N
MW171.22 g/mol
LogP0.14
Rot. Bonds2

About N-methyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide

N-methyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide (PubChem CID 11030280) has the molecular formula C6H9N3OS and a molecular weight of 171.22 g/mol. Its IUPAC name is N-methyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide.

Molecular Properties

Compound NameN-methyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide
PubChem CID11030280
Molecular FormulaC6H9N3OS
Molecular Weight171.22 g/mol
Exact Mass171.05
IUPAC NameN-methyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide
SMILESCNC(=O)Cc1nc(C)ns1
InChIInChI=1S/C6H9N3OS/c1-4-8-6(11-9-4)3-5(10)7-2/h3H2,1-2H3,(H,7,10)
InChIKeyMOYUUZYJWZAUMN-UHFFFAOYSA-N
XLogP0.14
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.22
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide?
The IUPAC name of N-methyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide (CID 11030280) is N-methyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide.
What is the SMILES notation for N-methyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide?
The canonical SMILES for N-methyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide is CNC(=O)Cc1nc(C)ns1.
What is the InChIKey of N-methyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide?
The InChIKey is MOYUUZYJWZAUMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3OS/c1-4-8-6(11-9-4)3-5(10)7-2/h3H2,1-2H3,(H,7,10).
What are the key properties of N-methyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide?
N-methyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide has a molecular weight of 171.22 g/mol, XLogP of 0.14, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide is sourced from PubChem (CID 11030280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).