2-[(6-amino-3-pyridinyl)sulfanyl]acetamide

C7H9N3OS — CID 43302194

IUPAC2-[(6-amino-3-pyridinyl)sulfanyl]acetamide
SMILESNC(=O)CSc1ccc(N)nc1
InChIInChI=1S/C7H9N3OS/c8-6-2-1-5(3-10-6)12-4-7(9)11/h1-3H,4H2,(H2,8,10)(H2,9,11)
InChIKeyYNUQVZWXPJWFJM-UHFFFAOYSA-N
MW183.24 g/mol
LogP0.24
Rot. Bonds3

About 2-[(6-amino-3-pyridinyl)sulfanyl]acetamide

2-[(6-amino-3-pyridinyl)sulfanyl]acetamide (PubChem CID 43302194) has the molecular formula C7H9N3OS and a molecular weight of 183.24 g/mol. Its IUPAC name is 2-[(6-amino-3-pyridinyl)sulfanyl]acetamide.

Molecular Properties

Compound Name2-[(6-amino-3-pyridinyl)sulfanyl]acetamide
PubChem CID43302194
Molecular FormulaC7H9N3OS
Molecular Weight183.24 g/mol
Exact Mass183.05
IUPAC Name2-[(6-amino-3-pyridinyl)sulfanyl]acetamide
SMILESNC(=O)CSc1ccc(N)nc1
InChIInChI=1S/C7H9N3OS/c8-6-2-1-5(3-10-6)12-4-7(9)11/h1-3H,4H2,(H2,8,10)(H2,9,11)
InChIKeyYNUQVZWXPJWFJM-UHFFFAOYSA-N
XLogP0.24
TPSA82.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.24
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-3-pyridinyl)sulfanyl]acetamide?
The IUPAC name of 2-[(6-amino-3-pyridinyl)sulfanyl]acetamide (CID 43302194) is 2-[(6-amino-3-pyridinyl)sulfanyl]acetamide.
What is the SMILES notation for 2-[(6-amino-3-pyridinyl)sulfanyl]acetamide?
The canonical SMILES for 2-[(6-amino-3-pyridinyl)sulfanyl]acetamide is NC(=O)CSc1ccc(N)nc1.
What is the InChIKey of 2-[(6-amino-3-pyridinyl)sulfanyl]acetamide?
The InChIKey is YNUQVZWXPJWFJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3OS/c8-6-2-1-5(3-10-6)12-4-7(9)11/h1-3H,4H2,(H2,8,10)(H2,9,11).
What are the key properties of 2-[(6-amino-3-pyridinyl)sulfanyl]acetamide?
2-[(6-amino-3-pyridinyl)sulfanyl]acetamide has a molecular weight of 183.24 g/mol, XLogP of 0.24, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-3-pyridinyl)sulfanyl]acetamide is sourced from PubChem (CID 43302194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).