2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide

C7H11N3OS — CID 61285054

IUPAC2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide
SMILESCNCC(=O)NCc1nccs1
InChIInChI=1S/C7H11N3OS/c1-8-4-6(11)10-5-7-9-2-3-12-7/h2-3,8H,4-5H2,1H3,(H,10,11)
InChIKeyVUMIZBUZLCWZLW-UHFFFAOYSA-N
MW185.25 g/mol
LogP-0.02
Rot. Bonds4

About 2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide

2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide (PubChem CID 61285054) has the molecular formula C7H11N3OS and a molecular weight of 185.25 g/mol. Its IUPAC name is 2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide
PubChem CID61285054
Molecular FormulaC7H11N3OS
Molecular Weight185.25 g/mol
Exact Mass185.06
IUPAC Name2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide
SMILESCNCC(=O)NCc1nccs1
InChIInChI=1S/C7H11N3OS/c1-8-4-6(11)10-5-7-9-2-3-12-7/h2-3,8H,4-5H2,1H3,(H,10,11)
InChIKeyVUMIZBUZLCWZLW-UHFFFAOYSA-N
XLogP-0.02
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.25
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide?
The IUPAC name of 2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide (CID 61285054) is 2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide?
The canonical SMILES for 2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide is CNCC(=O)NCc1nccs1.
What is the InChIKey of 2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide?
The InChIKey is VUMIZBUZLCWZLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3OS/c1-8-4-6(11)10-5-7-9-2-3-12-7/h2-3,8H,4-5H2,1H3,(H,10,11).
What are the key properties of 2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide?
2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide has a molecular weight of 185.25 g/mol, XLogP of -0.02, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide is sourced from PubChem (CID 61285054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).