2-[(3-amino-2-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide

C10H15N3O2S — CID 43300619

IUPAC2-[(3-amino-2-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CSc1ncccc1N
InChIInChI=1S/C10H15N3O2S/c1-15-6-5-12-9(14)7-16-10-8(11)3-2-4-13-10/h2-4H,5-7,11H2,1H3,(H,12,14)
InChIKeyRCGAFTPELRMRBZ-UHFFFAOYSA-N
MW241.32 g/mol
LogP0.52
Rot. Bonds6

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

2-[(3-amino-2-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide (PubChem CID 43300619) has the molecular formula C10H15N3O2S and a molecular weight of 241.32 g/mol. Its IUPAC name is 2-[(3-amino-2-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-[(3-amino-2-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide
PubChem CID43300619
Molecular FormulaC10H15N3O2S
Molecular Weight241.32 g/mol
Exact Mass241.09
IUPAC Name2-[(3-amino-2-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CSc1ncccc1N
InChIInChI=1S/C10H15N3O2S/c1-15-6-5-12-9(14)7-16-10-8(11)3-2-4-13-10/h2-4H,5-7,11H2,1H3,(H,12,14)
InChIKeyRCGAFTPELRMRBZ-UHFFFAOYSA-N
XLogP0.52
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 104740778
2-[(3-amino-2-pyridinyl)sulfanyl]-N-prop-2-enylacetamide
CID 43300833
N-(2-methoxyethyl)-2-(3-phenoxypyrazin-2-yl)sulfanylacetamide
CID 53130109
2-[(3-amino-2-pyridinyl)sulfanyl]-N-(furan-2-ylmethyl)acetamide
CID 43300547
2-[(3-amino-4-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide
CID 43299918
2-[(3-amino-2-pyridinyl)sulfanyl]-N-[2-(cyclohexen-1-yl)ethyl]acetamide
CID 43300568
2-[(3-amino-2-pyridinyl)sulfanyl]-N-phenylacetamide
CID 43300867
2-[(3-amino-2-pyridinyl)sulfanyl]-N-butan-2-ylacetamide
CID 43300815
N-(2-methoxyethylcarbamoyl)-2-pyrimidin-2-ylsulfanylacetamide
CID 2651102
3-[(3-amino-2-pyridinyl)sulfonylamino]-N-(2-methoxyethyl)propanamide
CID 103307140
2-(2-amino-5-methylphenyl)sulfanyl-N-(2-methoxyethyl)acetamide
CID 79142889
3-amino-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 104740997

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-2-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-[(3-amino-2-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide (CID 43300619) is 2-[(3-amino-2-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-[(3-amino-2-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-[(3-amino-2-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide is COCCNC(=O)CSc1ncccc1N.
What is the InChIKey of 2-[(3-amino-2-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide?
The InChIKey is RCGAFTPELRMRBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2S/c1-15-6-5-12-9(14)7-16-10-8(11)3-2-4-13-10/h2-4H,5-7,11H2,1H3,(H,12,14).
What are the key properties of 2-[(3-amino-2-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide?
2-[(3-amino-2-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide has a molecular weight of 241.32 g/mol, XLogP of 0.52, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-2-pyridinyl)sulfanyl]-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 43300619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).