5-amino-N-cyclobutylthiadiazole-4-carboxamide

C7H10N4OS — CID 105451503

IUPAC5-amino-N-cyclobutylthiadiazole-4-carboxamide
SMILESNc1snnc1C(=O)NC1CCC1
InChIInChI=1S/C7H10N4OS/c8-6-5(10-11-13-6)7(12)9-4-2-1-3-4/h4H,1-3,8H2,(H,9,12)
InChIKeyQVSWHXDLRWRFPA-UHFFFAOYSA-N
MW198.25 g/mol
LogP0.40
Rot. Bonds2

About 5-amino-N-cyclobutylthiadiazole-4-carboxamide

5-amino-N-cyclobutylthiadiazole-4-carboxamide (PubChem CID 105451503) has the molecular formula C7H10N4OS and a molecular weight of 198.25 g/mol. Its IUPAC name is 5-amino-N-cyclobutylthiadiazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-N-cyclobutylthiadiazole-4-carboxamide
PubChem CID105451503
Molecular FormulaC7H10N4OS
Molecular Weight198.25 g/mol
Exact Mass198.06
IUPAC Name5-amino-N-cyclobutylthiadiazole-4-carboxamide
SMILESNc1snnc1C(=O)NC1CCC1
InChIInChI=1S/C7H10N4OS/c8-6-5(10-11-13-6)7(12)9-4-2-1-3-4/h4H,1-3,8H2,(H,9,12)
InChIKeyQVSWHXDLRWRFPA-UHFFFAOYSA-N
XLogP0.40
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.25
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-amino-N-cyclobutylthiadiazole-4-carboxamide?
The IUPAC name of 5-amino-N-cyclobutylthiadiazole-4-carboxamide (CID 105451503) is 5-amino-N-cyclobutylthiadiazole-4-carboxamide.
What is the SMILES notation for 5-amino-N-cyclobutylthiadiazole-4-carboxamide?
The canonical SMILES for 5-amino-N-cyclobutylthiadiazole-4-carboxamide is Nc1snnc1C(=O)NC1CCC1.
What is the InChIKey of 5-amino-N-cyclobutylthiadiazole-4-carboxamide?
The InChIKey is QVSWHXDLRWRFPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4OS/c8-6-5(10-11-13-6)7(12)9-4-2-1-3-4/h4H,1-3,8H2,(H,9,12).
What are the key properties of 5-amino-N-cyclobutylthiadiazole-4-carboxamide?
5-amino-N-cyclobutylthiadiazole-4-carboxamide has a molecular weight of 198.25 g/mol, XLogP of 0.40, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-cyclobutylthiadiazole-4-carboxamide is sourced from PubChem (CID 105451503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).