N-(2-fluoroethyl)thiadiazole-5-carboxamide

C5H6FN3OS — CID 130693984

IUPACN-(2-fluoroethyl)thiadiazole-5-carboxamide
SMILESO=C(NCCF)c1cnns1
InChIInChI=1S/C5H6FN3OS/c6-1-2-7-5(10)4-3-8-9-11-4/h3H,1-2H2,(H,7,10)
InChIKeyKUQISAVXKCUZLJ-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.24
Rot. Bonds3

About N-(2-fluoroethyl)thiadiazole-5-carboxamide

N-(2-fluoroethyl)thiadiazole-5-carboxamide (PubChem CID 130693984) has the molecular formula C5H6FN3OS and a molecular weight of 175.19 g/mol. Its IUPAC name is N-(2-fluoroethyl)thiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-fluoroethyl)thiadiazole-5-carboxamide
PubChem CID130693984
Molecular FormulaC5H6FN3OS
Molecular Weight175.19 g/mol
Exact Mass175.02
IUPAC NameN-(2-fluoroethyl)thiadiazole-5-carboxamide
SMILESO=C(NCCF)c1cnns1
InChIInChI=1S/C5H6FN3OS/c6-1-2-7-5(10)4-3-8-9-11-4/h3H,1-2H2,(H,7,10)
InChIKeyKUQISAVXKCUZLJ-UHFFFAOYSA-N
XLogP0.24
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)thiadiazole-5-carboxamide?
The IUPAC name of N-(2-fluoroethyl)thiadiazole-5-carboxamide (CID 130693984) is N-(2-fluoroethyl)thiadiazole-5-carboxamide.
What is the SMILES notation for N-(2-fluoroethyl)thiadiazole-5-carboxamide?
The canonical SMILES for N-(2-fluoroethyl)thiadiazole-5-carboxamide is O=C(NCCF)c1cnns1.
What is the InChIKey of N-(2-fluoroethyl)thiadiazole-5-carboxamide?
The InChIKey is KUQISAVXKCUZLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6FN3OS/c6-1-2-7-5(10)4-3-8-9-11-4/h3H,1-2H2,(H,7,10).
What are the key properties of N-(2-fluoroethyl)thiadiazole-5-carboxamide?
N-(2-fluoroethyl)thiadiazole-5-carboxamide has a molecular weight of 175.19 g/mol, XLogP of 0.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)thiadiazole-5-carboxamide is sourced from PubChem (CID 130693984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).