N-(5-azaspiro[3.5]nonan-8-yl)thiadiazole-5-carboxamide

C11H16N4OS — CID 43595166

IUPACN-(5-azaspiro[3.5]nonan-8-yl)thiadiazole-5-carboxamide
SMILESO=C(NC1CCNC2(CCC2)C1)c1cnns1
InChIInChI=1S/C11H16N4OS/c16-10(9-7-13-15-17-9)14-8-2-5-12-11(6-8)3-1-4-11/h7-8,12H,1-6H2,(H,14,16)
InChIKeyZFYPEHBDBKENBE-UHFFFAOYSA-N
MW252.34 g/mol
LogP0.94
Rot. Bonds2

About N-(5-azaspiro[3.5]nonan-8-yl)thiadiazole-5-carboxamide

N-(5-azaspiro[3.5]nonan-8-yl)thiadiazole-5-carboxamide (PubChem CID 43595166) has the molecular formula C11H16N4OS and a molecular weight of 252.34 g/mol. Its IUPAC name is N-(5-azaspiro[3.5]nonan-8-yl)thiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-(5-azaspiro[3.5]nonan-8-yl)thiadiazole-5-carboxamide
PubChem CID43595166
Molecular FormulaC11H16N4OS
Molecular Weight252.34 g/mol
Exact Mass252.10
IUPAC NameN-(5-azaspiro[3.5]nonan-8-yl)thiadiazole-5-carboxamide
SMILESO=C(NC1CCNC2(CCC2)C1)c1cnns1
InChIInChI=1S/C11H16N4OS/c16-10(9-7-13-15-17-9)14-8-2-5-12-11(6-8)3-1-4-11/h7-8,12H,1-6H2,(H,14,16)
InChIKeyZFYPEHBDBKENBE-UHFFFAOYSA-N
XLogP0.94
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.34
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-azaspiro[3.5]nonan-8-yl)thiadiazole-5-carboxamide?
The IUPAC name of N-(5-azaspiro[3.5]nonan-8-yl)thiadiazole-5-carboxamide (CID 43595166) is N-(5-azaspiro[3.5]nonan-8-yl)thiadiazole-5-carboxamide.
What is the SMILES notation for N-(5-azaspiro[3.5]nonan-8-yl)thiadiazole-5-carboxamide?
The canonical SMILES for N-(5-azaspiro[3.5]nonan-8-yl)thiadiazole-5-carboxamide is O=C(NC1CCNC2(CCC2)C1)c1cnns1.
What is the InChIKey of N-(5-azaspiro[3.5]nonan-8-yl)thiadiazole-5-carboxamide?
The InChIKey is ZFYPEHBDBKENBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4OS/c16-10(9-7-13-15-17-9)14-8-2-5-12-11(6-8)3-1-4-11/h7-8,12H,1-6H2,(H,14,16).
What are the key properties of N-(5-azaspiro[3.5]nonan-8-yl)thiadiazole-5-carboxamide?
N-(5-azaspiro[3.5]nonan-8-yl)thiadiazole-5-carboxamide has a molecular weight of 252.34 g/mol, XLogP of 0.94, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-azaspiro[3.5]nonan-8-yl)thiadiazole-5-carboxamide is sourced from PubChem (CID 43595166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).