N-(thiadiazol-4-yl)cyclopropanecarboxamide

C6H7N3OS — CID 70119269

IUPACN-(thiadiazol-4-yl)cyclopropanecarboxamide
SMILESO=C(Nc1csnn1)C1CC1
InChIInChI=1S/C6H7N3OS/c10-6(4-1-2-4)7-5-3-11-9-8-5/h3-4H,1-2H2,(H,7,10)
InChIKeyXYOHQHZHIIZJEV-UHFFFAOYSA-N
MW169.21 g/mol
LogP0.89
Rot. Bonds2

About N-(thiadiazol-4-yl)cyclopropanecarboxamide

N-(thiadiazol-4-yl)cyclopropanecarboxamide (PubChem CID 70119269) has the molecular formula C6H7N3OS and a molecular weight of 169.21 g/mol. Its IUPAC name is N-(thiadiazol-4-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(thiadiazol-4-yl)cyclopropanecarboxamide
PubChem CID70119269
Molecular FormulaC6H7N3OS
Molecular Weight169.21 g/mol
Exact Mass169.03
IUPAC NameN-(thiadiazol-4-yl)cyclopropanecarboxamide
SMILESO=C(Nc1csnn1)C1CC1
InChIInChI=1S/C6H7N3OS/c10-6(4-1-2-4)7-5-3-11-9-8-5/h3-4H,1-2H2,(H,7,10)
InChIKeyXYOHQHZHIIZJEV-UHFFFAOYSA-N
XLogP0.89
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.21
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(thiadiazol-4-yl)cyclopropanecarboxamide?
The IUPAC name of N-(thiadiazol-4-yl)cyclopropanecarboxamide (CID 70119269) is N-(thiadiazol-4-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-(thiadiazol-4-yl)cyclopropanecarboxamide?
The canonical SMILES for N-(thiadiazol-4-yl)cyclopropanecarboxamide is O=C(Nc1csnn1)C1CC1.
What is the InChIKey of N-(thiadiazol-4-yl)cyclopropanecarboxamide?
The InChIKey is XYOHQHZHIIZJEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3OS/c10-6(4-1-2-4)7-5-3-11-9-8-5/h3-4H,1-2H2,(H,7,10).
What are the key properties of N-(thiadiazol-4-yl)cyclopropanecarboxamide?
N-(thiadiazol-4-yl)cyclopropanecarboxamide has a molecular weight of 169.21 g/mol, XLogP of 0.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thiadiazol-4-yl)cyclopropanecarboxamide is sourced from PubChem (CID 70119269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).