2-(methylamino)-N-(2-methylthiolan-3-yl)acetamide

C8H16N2OS — CID 130648498

IUPAC2-(methylamino)-N-(2-methylthiolan-3-yl)acetamide
SMILESCNCC(=O)NC1CCSC1C
InChIInChI=1S/C8H16N2OS/c1-6-7(3-4-12-6)10-8(11)5-9-2/h6-7,9H,3-5H2,1-2H3,(H,10,11)
InChIKeyFMEUEMSUKWMNTP-UHFFFAOYSA-N
MW188.30 g/mol
LogP0.22
Rot. Bonds3

About 2-(methylamino)-N-(2-methylthiolan-3-yl)acetamide

2-(methylamino)-N-(2-methylthiolan-3-yl)acetamide (PubChem CID 130648498) has the molecular formula C8H16N2OS and a molecular weight of 188.30 g/mol. Its IUPAC name is 2-(methylamino)-N-(2-methylthiolan-3-yl)acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-(2-methylthiolan-3-yl)acetamide
PubChem CID130648498
Molecular FormulaC8H16N2OS
Molecular Weight188.30 g/mol
Exact Mass188.10
IUPAC Name2-(methylamino)-N-(2-methylthiolan-3-yl)acetamide
SMILESCNCC(=O)NC1CCSC1C
InChIInChI=1S/C8H16N2OS/c1-6-7(3-4-12-6)10-8(11)5-9-2/h6-7,9H,3-5H2,1-2H3,(H,10,11)
InChIKeyFMEUEMSUKWMNTP-UHFFFAOYSA-N
XLogP0.22
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.30
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(2-methylthiolan-3-yl)acetamide?
The IUPAC name of 2-(methylamino)-N-(2-methylthiolan-3-yl)acetamide (CID 130648498) is 2-(methylamino)-N-(2-methylthiolan-3-yl)acetamide.
What is the SMILES notation for 2-(methylamino)-N-(2-methylthiolan-3-yl)acetamide?
The canonical SMILES for 2-(methylamino)-N-(2-methylthiolan-3-yl)acetamide is CNCC(=O)NC1CCSC1C.
What is the InChIKey of 2-(methylamino)-N-(2-methylthiolan-3-yl)acetamide?
The InChIKey is FMEUEMSUKWMNTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2OS/c1-6-7(3-4-12-6)10-8(11)5-9-2/h6-7,9H,3-5H2,1-2H3,(H,10,11).
What are the key properties of 2-(methylamino)-N-(2-methylthiolan-3-yl)acetamide?
2-(methylamino)-N-(2-methylthiolan-3-yl)acetamide has a molecular weight of 188.30 g/mol, XLogP of 0.22, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(2-methylthiolan-3-yl)acetamide is sourced from PubChem (CID 130648498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).