N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide

C9H14N4OS — CID 116658033

IUPACN-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide
SMILESCc1nsc(NC(=O)N2CCCCC2)n1
InChIInChI=1S/C9H14N4OS/c1-7-10-8(15-12-7)11-9(14)13-5-3-2-4-6-13/h2-6H2,1H3,(H,10,11,12,14)
InChIKeyWYFMAHNRYPXQMO-UHFFFAOYSA-N
MW226.30 g/mol
LogP1.86
Rot. Bonds1

About N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide

N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide (PubChem CID 116658033) has the molecular formula C9H14N4OS and a molecular weight of 226.30 g/mol. Its IUPAC name is N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide
PubChem CID116658033
Molecular FormulaC9H14N4OS
Molecular Weight226.30 g/mol
Exact Mass226.09
IUPAC NameN-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide
SMILESCc1nsc(NC(=O)N2CCCCC2)n1
InChIInChI=1S/C9H14N4OS/c1-7-10-8(15-12-7)11-9(14)13-5-3-2-4-6-13/h2-6H2,1H3,(H,10,11,12,14)
InChIKeyWYFMAHNRYPXQMO-UHFFFAOYSA-N
XLogP1.86
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide?
The IUPAC name of N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide (CID 116658033) is N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide?
The canonical SMILES for N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide is Cc1nsc(NC(=O)N2CCCCC2)n1.
What is the InChIKey of N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide?
The InChIKey is WYFMAHNRYPXQMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4OS/c1-7-10-8(15-12-7)11-9(14)13-5-3-2-4-6-13/h2-6H2,1H3,(H,10,11,12,14).
What are the key properties of N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide?
N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide has a molecular weight of 226.30 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide is sourced from PubChem (CID 116658033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).