2,2-difluoro-N-(thiadiazol-5-yl)propanamide

C5H5F2N3OS — CID 130665224

IUPAC2,2-difluoro-N-(thiadiazol-5-yl)propanamide
SMILESCC(F)(F)C(=O)Nc1cnns1
InChIInChI=1S/C5H5F2N3OS/c1-5(6,7)4(11)9-3-2-8-10-12-3/h2H,1H3,(H,9,11)
InChIKeyNONBUHMNGZRBCW-UHFFFAOYSA-N
MW193.18 g/mol
LogP1.13
Rot. Bonds2

About 2,2-difluoro-N-(thiadiazol-5-yl)propanamide

2,2-difluoro-N-(thiadiazol-5-yl)propanamide (PubChem CID 130665224) has the molecular formula C5H5F2N3OS and a molecular weight of 193.18 g/mol. Its IUPAC name is 2,2-difluoro-N-(thiadiazol-5-yl)propanamide.

Molecular Properties

Compound Name2,2-difluoro-N-(thiadiazol-5-yl)propanamide
PubChem CID130665224
Molecular FormulaC5H5F2N3OS
Molecular Weight193.18 g/mol
Exact Mass193.01
IUPAC Name2,2-difluoro-N-(thiadiazol-5-yl)propanamide
SMILESCC(F)(F)C(=O)Nc1cnns1
InChIInChI=1S/C5H5F2N3OS/c1-5(6,7)4(11)9-3-2-8-10-12-3/h2H,1H3,(H,9,11)
InChIKeyNONBUHMNGZRBCW-UHFFFAOYSA-N
XLogP1.13
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.18
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-(thiadiazol-5-yl)propanamide?
The IUPAC name of 2,2-difluoro-N-(thiadiazol-5-yl)propanamide (CID 130665224) is 2,2-difluoro-N-(thiadiazol-5-yl)propanamide.
What is the SMILES notation for 2,2-difluoro-N-(thiadiazol-5-yl)propanamide?
The canonical SMILES for 2,2-difluoro-N-(thiadiazol-5-yl)propanamide is CC(F)(F)C(=O)Nc1cnns1.
What is the InChIKey of 2,2-difluoro-N-(thiadiazol-5-yl)propanamide?
The InChIKey is NONBUHMNGZRBCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5F2N3OS/c1-5(6,7)4(11)9-3-2-8-10-12-3/h2H,1H3,(H,9,11).
What are the key properties of 2,2-difluoro-N-(thiadiazol-5-yl)propanamide?
2,2-difluoro-N-(thiadiazol-5-yl)propanamide has a molecular weight of 193.18 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 2,2-difluoro-N-(thiadiazol-5-yl)propanamide is sourced from PubChem (CID 130665224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).