2-fluoro-2-methyl-N-(thiadiazol-5-ylmethyl)propanamide

C7H10FN3OS — CID 130986241

IUPAC2-fluoro-2-methyl-N-(thiadiazol-5-ylmethyl)propanamide
SMILESCC(C)(F)C(=O)NCc1cnns1
InChIInChI=1S/C7H10FN3OS/c1-7(2,8)6(12)9-3-5-4-10-11-13-5/h4H,3H2,1-2H3,(H,9,12)
InChIKeyDLZDYIBYKVFBLS-UHFFFAOYSA-N
MW203.24 g/mol
LogP0.90
Rot. Bonds3

About 2-fluoro-2-methyl-N-(thiadiazol-5-ylmethyl)propanamide

2-fluoro-2-methyl-N-(thiadiazol-5-ylmethyl)propanamide (PubChem CID 130986241) has the molecular formula C7H10FN3OS and a molecular weight of 203.24 g/mol. Its IUPAC name is 2-fluoro-2-methyl-N-(thiadiazol-5-ylmethyl)propanamide.

Molecular Properties

Compound Name2-fluoro-2-methyl-N-(thiadiazol-5-ylmethyl)propanamide
PubChem CID130986241
Molecular FormulaC7H10FN3OS
Molecular Weight203.24 g/mol
Exact Mass203.05
IUPAC Name2-fluoro-2-methyl-N-(thiadiazol-5-ylmethyl)propanamide
SMILESCC(C)(F)C(=O)NCc1cnns1
InChIInChI=1S/C7H10FN3OS/c1-7(2,8)6(12)9-3-5-4-10-11-13-5/h4H,3H2,1-2H3,(H,9,12)
InChIKeyDLZDYIBYKVFBLS-UHFFFAOYSA-N
XLogP0.90
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-methyl-N-(thiadiazol-5-ylmethyl)propanamide?
The IUPAC name of 2-fluoro-2-methyl-N-(thiadiazol-5-ylmethyl)propanamide (CID 130986241) is 2-fluoro-2-methyl-N-(thiadiazol-5-ylmethyl)propanamide.
What is the SMILES notation for 2-fluoro-2-methyl-N-(thiadiazol-5-ylmethyl)propanamide?
The canonical SMILES for 2-fluoro-2-methyl-N-(thiadiazol-5-ylmethyl)propanamide is CC(C)(F)C(=O)NCc1cnns1.
What is the InChIKey of 2-fluoro-2-methyl-N-(thiadiazol-5-ylmethyl)propanamide?
The InChIKey is DLZDYIBYKVFBLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10FN3OS/c1-7(2,8)6(12)9-3-5-4-10-11-13-5/h4H,3H2,1-2H3,(H,9,12).
What are the key properties of 2-fluoro-2-methyl-N-(thiadiazol-5-ylmethyl)propanamide?
2-fluoro-2-methyl-N-(thiadiazol-5-ylmethyl)propanamide has a molecular weight of 203.24 g/mol, XLogP of 0.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-methyl-N-(thiadiazol-5-ylmethyl)propanamide is sourced from PubChem (CID 130986241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).