5-methoxy-N-(thiadiazol-5-yl)pentanamide

C8H13N3O2S — CID 86818192

IUPAC5-methoxy-N-(thiadiazol-5-yl)pentanamide
SMILESCOCCCCC(=O)Nc1cnns1
InChIInChI=1S/C8H13N3O2S/c1-13-5-3-2-4-7(12)10-8-6-9-11-14-8/h6H,2-5H2,1H3,(H,10,12)
InChIKeyUPIPRKFJYWEZBW-UHFFFAOYSA-N
MW215.28 g/mol
LogP1.29
Rot. Bonds6

About 5-methoxy-N-(thiadiazol-5-yl)pentanamide

5-methoxy-N-(thiadiazol-5-yl)pentanamide (PubChem CID 86818192) has the molecular formula C8H13N3O2S and a molecular weight of 215.28 g/mol. Its IUPAC name is 5-methoxy-N-(thiadiazol-5-yl)pentanamide.

Molecular Properties

Compound Name5-methoxy-N-(thiadiazol-5-yl)pentanamide
PubChem CID86818192
Molecular FormulaC8H13N3O2S
Molecular Weight215.28 g/mol
Exact Mass215.07
IUPAC Name5-methoxy-N-(thiadiazol-5-yl)pentanamide
SMILESCOCCCCC(=O)Nc1cnns1
InChIInChI=1S/C8H13N3O2S/c1-13-5-3-2-4-7(12)10-8-6-9-11-14-8/h6H,2-5H2,1H3,(H,10,12)
InChIKeyUPIPRKFJYWEZBW-UHFFFAOYSA-N
XLogP1.29
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.28
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-(thiadiazol-5-yl)pentanamide?
The IUPAC name of 5-methoxy-N-(thiadiazol-5-yl)pentanamide (CID 86818192) is 5-methoxy-N-(thiadiazol-5-yl)pentanamide.
What is the SMILES notation for 5-methoxy-N-(thiadiazol-5-yl)pentanamide?
The canonical SMILES for 5-methoxy-N-(thiadiazol-5-yl)pentanamide is COCCCCC(=O)Nc1cnns1.
What is the InChIKey of 5-methoxy-N-(thiadiazol-5-yl)pentanamide?
The InChIKey is UPIPRKFJYWEZBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2S/c1-13-5-3-2-4-7(12)10-8-6-9-11-14-8/h6H,2-5H2,1H3,(H,10,12).
What are the key properties of 5-methoxy-N-(thiadiazol-5-yl)pentanamide?
5-methoxy-N-(thiadiazol-5-yl)pentanamide has a molecular weight of 215.28 g/mol, XLogP of 1.29, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-(thiadiazol-5-yl)pentanamide is sourced from PubChem (CID 86818192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).