2-methyl-N-(thiadiazol-5-yl)propanamide

C6H9N3OS — CID 103846148

IUPAC2-methyl-N-(thiadiazol-5-yl)propanamide
SMILESCC(C)C(=O)Nc1cnns1
InChIInChI=1S/C6H9N3OS/c1-4(2)6(10)8-5-3-7-9-11-5/h3-4H,1-2H3,(H,8,10)
InChIKeyWVXRJDFCTRZCJS-UHFFFAOYSA-N
MW171.22 g/mol
LogP1.13
Rot. Bonds2

About 2-methyl-N-(thiadiazol-5-yl)propanamide

2-methyl-N-(thiadiazol-5-yl)propanamide (PubChem CID 103846148) has the molecular formula C6H9N3OS and a molecular weight of 171.22 g/mol. Its IUPAC name is 2-methyl-N-(thiadiazol-5-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(thiadiazol-5-yl)propanamide
PubChem CID103846148
Molecular FormulaC6H9N3OS
Molecular Weight171.22 g/mol
Exact Mass171.05
IUPAC Name2-methyl-N-(thiadiazol-5-yl)propanamide
SMILESCC(C)C(=O)Nc1cnns1
InChIInChI=1S/C6H9N3OS/c1-4(2)6(10)8-5-3-7-9-11-5/h3-4H,1-2H3,(H,8,10)
InChIKeyWVXRJDFCTRZCJS-UHFFFAOYSA-N
XLogP1.13
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 ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(thiadiazol-5-yl)propanamide?
The IUPAC name of 2-methyl-N-(thiadiazol-5-yl)propanamide (CID 103846148) is 2-methyl-N-(thiadiazol-5-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(thiadiazol-5-yl)propanamide?
The canonical SMILES for 2-methyl-N-(thiadiazol-5-yl)propanamide is CC(C)C(=O)Nc1cnns1.
What is the InChIKey of 2-methyl-N-(thiadiazol-5-yl)propanamide?
The InChIKey is WVXRJDFCTRZCJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3OS/c1-4(2)6(10)8-5-3-7-9-11-5/h3-4H,1-2H3,(H,8,10).
What are the key properties of 2-methyl-N-(thiadiazol-5-yl)propanamide?
2-methyl-N-(thiadiazol-5-yl)propanamide has a molecular weight of 171.22 g/mol, XLogP of 1.13, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(thiadiazol-5-yl)propanamide is sourced from PubChem (CID 103846148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).