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

C7H12N4OS — CID 1091546

IUPAC2-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
SMILESCc1nnc(NC(=O)CN(C)C)s1
InChIInChI=1S/C7H12N4OS/c1-5-9-10-7(13-5)8-6(12)4-11(2)3/h4H2,1-3H3,(H,8,10,12)
InChIKeyWFMQQSPXESEKCR-UHFFFAOYSA-N
MW200.27 g/mol
LogP0.35
Rot. Bonds3

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

2-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide (PubChem CID 1091546) has the molecular formula C7H12N4OS and a molecular weight of 200.27 g/mol. Its IUPAC name is 2-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
PubChem CID1091546
Molecular FormulaC7H12N4OS
Molecular Weight200.27 g/mol
Exact Mass200.07
IUPAC Name2-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
SMILESCc1nnc(NC(=O)CN(C)C)s1
InChIInChI=1S/C7H12N4OS/c1-5-9-10-7(13-5)8-6(12)4-11(2)3/h4H2,1-3H3,(H,8,10,12)
InChIKeyWFMQQSPXESEKCR-UHFFFAOYSA-N
XLogP0.35
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.27
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide?
The IUPAC name of 2-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide (CID 1091546) is 2-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide.
What is the SMILES notation for 2-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide?
The canonical SMILES for 2-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide is Cc1nnc(NC(=O)CN(C)C)s1.
What is the InChIKey of 2-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide?
The InChIKey is WFMQQSPXESEKCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4OS/c1-5-9-10-7(13-5)8-6(12)4-11(2)3/h4H2,1-3H3,(H,8,10,12).
What are the key properties of 2-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide?
2-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide has a molecular weight of 200.27 g/mol, XLogP of 0.35, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide is sourced from PubChem (CID 1091546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).