N-cyclopentyl-2-(thiatriazol-5-ylsulfanyl)acetamide

C8H12N4OS2 — CID 43816075

IUPACN-cyclopentyl-2-(thiatriazol-5-ylsulfanyl)acetamide
SMILESO=C(CSc1nnns1)NC1CCCC1
InChIInChI=1S/C8H12N4OS2/c13-7(9-6-3-1-2-4-6)5-14-8-10-11-12-15-8/h6H,1-5H2,(H,9,13)
InChIKeyMZMUQTFUFHDNPN-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.08
Rot. Bonds4

About N-cyclopentyl-2-(thiatriazol-5-ylsulfanyl)acetamide

N-cyclopentyl-2-(thiatriazol-5-ylsulfanyl)acetamide (PubChem CID 43816075) has the molecular formula C8H12N4OS2 and a molecular weight of 244.34 g/mol. Its IUPAC name is N-cyclopentyl-2-(thiatriazol-5-ylsulfanyl)acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(thiatriazol-5-ylsulfanyl)acetamide
PubChem CID43816075
Molecular FormulaC8H12N4OS2
Molecular Weight244.34 g/mol
Exact Mass244.05
IUPAC NameN-cyclopentyl-2-(thiatriazol-5-ylsulfanyl)acetamide
SMILESO=C(CSc1nnns1)NC1CCCC1
InChIInChI=1S/C8H12N4OS2/c13-7(9-6-3-1-2-4-6)5-14-8-10-11-12-15-8/h6H,1-5H2,(H,9,13)
InChIKeyMZMUQTFUFHDNPN-UHFFFAOYSA-N
XLogP1.08
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(thiatriazol-5-ylsulfanyl)acetamide?
The IUPAC name of N-cyclopentyl-2-(thiatriazol-5-ylsulfanyl)acetamide (CID 43816075) is N-cyclopentyl-2-(thiatriazol-5-ylsulfanyl)acetamide.
What is the SMILES notation for N-cyclopentyl-2-(thiatriazol-5-ylsulfanyl)acetamide?
The canonical SMILES for N-cyclopentyl-2-(thiatriazol-5-ylsulfanyl)acetamide is O=C(CSc1nnns1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-(thiatriazol-5-ylsulfanyl)acetamide?
The InChIKey is MZMUQTFUFHDNPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4OS2/c13-7(9-6-3-1-2-4-6)5-14-8-10-11-12-15-8/h6H,1-5H2,(H,9,13).
What are the key properties of N-cyclopentyl-2-(thiatriazol-5-ylsulfanyl)acetamide?
N-cyclopentyl-2-(thiatriazol-5-ylsulfanyl)acetamide has a molecular weight of 244.34 g/mol, XLogP of 1.08, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(thiatriazol-5-ylsulfanyl)acetamide is sourced from PubChem (CID 43816075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).