N-(6-piperidin-1-yl-3-pyridinyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide

C15H18N4OS2 — CID 71939492

IUPACN-(6-piperidin-1-yl-3-pyridinyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide
SMILESO=C(CSc1nccs1)Nc1ccc(N2CCCCC2)nc1
InChIInChI=1S/C15H18N4OS2/c20-14(11-22-15-16-6-9-21-15)18-12-4-5-13(17-10-12)19-7-2-1-3-8-19/h4-6,9-10H,1-3,7-8,11H2,(H,18,20)
InChIKeyOBANJMJDWUAMLK-UHFFFAOYSA-N
MW334.47 g/mol
LogP3.26
Rot. Bonds5

About N-(6-piperidin-1-yl-3-pyridinyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide

N-(6-piperidin-1-yl-3-pyridinyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide (PubChem CID 71939492) has the molecular formula C15H18N4OS2 and a molecular weight of 334.47 g/mol. Its IUPAC name is N-(6-piperidin-1-yl-3-pyridinyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide.

Molecular Properties

Compound NameN-(6-piperidin-1-yl-3-pyridinyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide
PubChem CID71939492
Molecular FormulaC15H18N4OS2
Molecular Weight334.47 g/mol
Exact Mass334.09
IUPAC NameN-(6-piperidin-1-yl-3-pyridinyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide
SMILESO=C(CSc1nccs1)Nc1ccc(N2CCCCC2)nc1
InChIInChI=1S/C15H18N4OS2/c20-14(11-22-15-16-6-9-21-15)18-12-4-5-13(17-10-12)19-7-2-1-3-8-19/h4-6,9-10H,1-3,7-8,11H2,(H,18,20)
InChIKeyOBANJMJDWUAMLK-UHFFFAOYSA-N
XLogP3.26
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.47
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiazol_SC_A(3)', 'substructure': 'N/A'}

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Related Compounds

N-[6-(azepan-1-yl)-3-pyridinyl]-2-piperidin-1-ylacetamide
CID 155391895
N-[6-(azepan-1-yl)-3-pyridinyl]-3,3-diphenylpropanamide
CID 113015896
N-(6-piperidin-1-yl-3-pyridinyl)pentanamide
CID 18144003
N-[6-(azepan-1-yl)-3-pyridinyl]-2-(cyclohexylamino)acetamide
CID 155391840
N-[6-(azepan-1-yl)-3-pyridinyl]-2-(cycloheptylamino)acetamide
CID 155391842
3-cyclopentyl-N-(6-piperidin-1-yl-3-pyridinyl)propanamide
CID 52549781
2-(2-bromophenyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide
CID 113009839
6-amino-N-(6-piperidin-1-yl-3-pyridinyl)hexanamide
CID 43704579
N-[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-pyridinyl]-2-methylsulfanylacetamide
CID 30896219
3-amino-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide
CID 60836509
2-(4-oxoquinolin-1-yl)-N-(6-piperidin-1-yl-3-pyridinyl)acetamide
CID 51126832
2,2-dimethyl-4-oxo-4-[(6-pyrrolidin-1-yl-3-pyridinyl)amino]butanoic acid
CID 65302404

Frequently Asked Questions

What is the IUPAC name of N-(6-piperidin-1-yl-3-pyridinyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide?
The IUPAC name of N-(6-piperidin-1-yl-3-pyridinyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide (CID 71939492) is N-(6-piperidin-1-yl-3-pyridinyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide.
What is the SMILES notation for N-(6-piperidin-1-yl-3-pyridinyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide?
The canonical SMILES for N-(6-piperidin-1-yl-3-pyridinyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide is O=C(CSc1nccs1)Nc1ccc(N2CCCCC2)nc1.
What is the InChIKey of N-(6-piperidin-1-yl-3-pyridinyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide?
The InChIKey is OBANJMJDWUAMLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4OS2/c20-14(11-22-15-16-6-9-21-15)18-12-4-5-13(17-10-12)19-7-2-1-3-8-19/h4-6,9-10H,1-3,7-8,11H2,(H,18,20).
What are the key properties of N-(6-piperidin-1-yl-3-pyridinyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide?
N-(6-piperidin-1-yl-3-pyridinyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide has a molecular weight of 334.47 g/mol, XLogP of 3.26, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-piperidin-1-yl-3-pyridinyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide is sourced from PubChem (CID 71939492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).