2-amino-N-(2-sulfanylethyl)acetamide

C4H10N2OS — CID 3078308

IUPAC2-amino-N-(2-sulfanylethyl)acetamide
SMILESNCC(=O)NCCS
InChIInChI=1S/C4H10N2OS/c5-3-4(7)6-1-2-8/h8H,1-3,5H2,(H,6,7)
InChIKeyJWWHIAWPJFFJBZ-UHFFFAOYSA-N
MW134.20 g/mol
LogP-1.01
Rot. Bonds3

About 2-amino-N-(2-sulfanylethyl)acetamide

2-amino-N-(2-sulfanylethyl)acetamide (PubChem CID 3078308) has the molecular formula C4H10N2OS and a molecular weight of 134.20 g/mol. Its IUPAC name is 2-amino-N-(2-sulfanylethyl)acetamide.

Molecular Properties

Compound Name2-amino-N-(2-sulfanylethyl)acetamide
PubChem CID3078308
Molecular FormulaC4H10N2OS
Molecular Weight134.20 g/mol
Exact Mass134.05
IUPAC Name2-amino-N-(2-sulfanylethyl)acetamide
SMILESNCC(=O)NCCS
InChIInChI=1S/C4H10N2OS/c5-3-4(7)6-1-2-8/h8H,1-3,5H2,(H,6,7)
InChIKeyJWWHIAWPJFFJBZ-UHFFFAOYSA-N
XLogP-1.01
TPSA55.12 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.20
LogP ≤ 5-1.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-sulfanylethyl)acetamide?
The IUPAC name of 2-amino-N-(2-sulfanylethyl)acetamide (CID 3078308) is 2-amino-N-(2-sulfanylethyl)acetamide.
What is the SMILES notation for 2-amino-N-(2-sulfanylethyl)acetamide?
The canonical SMILES for 2-amino-N-(2-sulfanylethyl)acetamide is NCC(=O)NCCS.
What is the InChIKey of 2-amino-N-(2-sulfanylethyl)acetamide?
The InChIKey is JWWHIAWPJFFJBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2OS/c5-3-4(7)6-1-2-8/h8H,1-3,5H2,(H,6,7).
What are the key properties of 2-amino-N-(2-sulfanylethyl)acetamide?
2-amino-N-(2-sulfanylethyl)acetamide has a molecular weight of 134.20 g/mol, XLogP of -1.01, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-sulfanylethyl)acetamide is sourced from PubChem (CID 3078308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).