N-(5-sulfanyl-2-pyridinyl)acetamide

C7H8N2OS — CID 67482224

IUPACN-(5-sulfanyl-2-pyridinyl)acetamide
SMILESCC(=O)Nc1ccc(S)cn1
InChIInChI=1S/C7H8N2OS/c1-5(10)9-7-3-2-6(11)4-8-7/h2-4,11H,1H3,(H,8,9,10)
InChIKeyHQEQIXOVBOJPEI-UHFFFAOYSA-N
MW168.22 g/mol
LogP1.33
Rot. Bonds1

About N-(5-sulfanyl-2-pyridinyl)acetamide

N-(5-sulfanyl-2-pyridinyl)acetamide (PubChem CID 67482224) has the molecular formula C7H8N2OS and a molecular weight of 168.22 g/mol. Its IUPAC name is N-(5-sulfanyl-2-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(5-sulfanyl-2-pyridinyl)acetamide
PubChem CID67482224
Molecular FormulaC7H8N2OS
Molecular Weight168.22 g/mol
Exact Mass168.04
IUPAC NameN-(5-sulfanyl-2-pyridinyl)acetamide
SMILESCC(=O)Nc1ccc(S)cn1
InChIInChI=1S/C7H8N2OS/c1-5(10)9-7-3-2-6(11)4-8-7/h2-4,11H,1H3,(H,8,9,10)
InChIKeyHQEQIXOVBOJPEI-UHFFFAOYSA-N
XLogP1.33
TPSA41.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.22
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

N-[5-(1-methoxyethyl)-2-pyridinyl]acetamide
CID 163950546
6-acetamidopyridine-3-sulfonic acid
CID 3292774
N-(5-dimethylphosphoryl-2-pyridinyl)acetamide
CID 59649348
N-(5-pyridin-4-yl-2-pyridinyl)acetamide
CID 102057434
N-[5-(2-hydroxyacetyl)-2-pyridinyl]acetamide
CID 15512450
ethane;N-[5-(4-methylphenyl)-2-pyridinyl]acetamide;molecular hydrogen
CID 145105834
N-[5-[(1S)-1-hydroxypropyl]-2-pyridinyl]acetamide
CID 54369170
N-[5-[(E)-2-(6-formamido-3-pyridinyl)ethenyl]-2-pyridinyl]acetamide
CID 134421519
methyl (E)-3-(6-acetamido-3-pyridinyl)prop-2-enoate
CID 86754877
N-[5-[(1S)-1-aminoprop-2-enyl]-2-pyridinyl]acetamide
CID 130955914
N-[5-[(1R)-1-aminoprop-2-enyl]-2-pyridinyl]acetamide
CID 55274663
N-[5-(4-fluoro-2-methylphenyl)-2-pyridinyl]acetamide
CID 118945921

Frequently Asked Questions

What is the IUPAC name of N-(5-sulfanyl-2-pyridinyl)acetamide?
The IUPAC name of N-(5-sulfanyl-2-pyridinyl)acetamide (CID 67482224) is N-(5-sulfanyl-2-pyridinyl)acetamide.
What is the SMILES notation for N-(5-sulfanyl-2-pyridinyl)acetamide?
The canonical SMILES for N-(5-sulfanyl-2-pyridinyl)acetamide is CC(=O)Nc1ccc(S)cn1.
What is the InChIKey of N-(5-sulfanyl-2-pyridinyl)acetamide?
The InChIKey is HQEQIXOVBOJPEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2OS/c1-5(10)9-7-3-2-6(11)4-8-7/h2-4,11H,1H3,(H,8,9,10).
What are the key properties of N-(5-sulfanyl-2-pyridinyl)acetamide?
N-(5-sulfanyl-2-pyridinyl)acetamide has a molecular weight of 168.22 g/mol, XLogP of 1.33, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-sulfanyl-2-pyridinyl)acetamide is sourced from PubChem (CID 67482224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).