N-(2-methylsulfinamoylethyl)acetamide

C5H12N2O2S — CID 135230818

IUPACN-(2-methylsulfinamoylethyl)acetamide
SMILESCNS(=O)CCNC(C)=O
InChIInChI=1S/C5H12N2O2S/c1-5(8)7-3-4-10(9)6-2/h6H,3-4H2,1-2H3,(H,7,8)
InChIKeyNFPHWOLVRVRIEX-UHFFFAOYSA-N
MW164.23 g/mol
LogP-0.99
Rot. Bonds4

About N-(2-methylsulfinamoylethyl)acetamide

N-(2-methylsulfinamoylethyl)acetamide (PubChem CID 135230818) has the molecular formula C5H12N2O2S and a molecular weight of 164.23 g/mol. Its IUPAC name is N-(2-methylsulfinamoylethyl)acetamide.

Molecular Properties

Compound NameN-(2-methylsulfinamoylethyl)acetamide
PubChem CID135230818
Molecular FormulaC5H12N2O2S
Molecular Weight164.23 g/mol
Exact Mass164.06
IUPAC NameN-(2-methylsulfinamoylethyl)acetamide
SMILESCNS(=O)CCNC(C)=O
InChIInChI=1S/C5H12N2O2S/c1-5(8)7-3-4-10(9)6-2/h6H,3-4H2,1-2H3,(H,7,8)
InChIKeyNFPHWOLVRVRIEX-UHFFFAOYSA-N
XLogP-0.99
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.23
LogP ≤ 5-0.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylsulfinamoylethyl)acetamide?
The IUPAC name of N-(2-methylsulfinamoylethyl)acetamide (CID 135230818) is N-(2-methylsulfinamoylethyl)acetamide.
What is the SMILES notation for N-(2-methylsulfinamoylethyl)acetamide?
The canonical SMILES for N-(2-methylsulfinamoylethyl)acetamide is CNS(=O)CCNC(C)=O.
What is the InChIKey of N-(2-methylsulfinamoylethyl)acetamide?
The InChIKey is NFPHWOLVRVRIEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O2S/c1-5(8)7-3-4-10(9)6-2/h6H,3-4H2,1-2H3,(H,7,8).
What are the key properties of N-(2-methylsulfinamoylethyl)acetamide?
N-(2-methylsulfinamoylethyl)acetamide has a molecular weight of 164.23 g/mol, XLogP of -0.99, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylsulfinamoylethyl)acetamide is sourced from PubChem (CID 135230818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).