2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide

C7H11N3O2S — CID 70598948

IUPAC2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide
SMILESCC(=O)NCC(=O)NC1=NCCS1
InChIInChI=1S/C7H11N3O2S/c1-5(11)9-4-6(12)10-7-8-2-3-13-7/h2-4H2,1H3,(H,9,11)(H,8,10,12)
InChIKeyWZZQVDWDHXIXST-UHFFFAOYSA-N
MW201.25 g/mol
LogP-0.66
Rot. Bonds2

About 2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide

2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide (PubChem CID 70598948) has the molecular formula C7H11N3O2S and a molecular weight of 201.25 g/mol. Its IUPAC name is 2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide
PubChem CID70598948
Molecular FormulaC7H11N3O2S
Molecular Weight201.25 g/mol
Exact Mass201.06
IUPAC Name2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide
SMILESCC(=O)NCC(=O)NC1=NCCS1
InChIInChI=1S/C7H11N3O2S/c1-5(11)9-4-6(12)10-7-8-2-3-13-7/h2-4H2,1H3,(H,9,11)(H,8,10,12)
InChIKeyWZZQVDWDHXIXST-UHFFFAOYSA-N
XLogP-0.66
TPSA70.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.25
LogP ≤ 5-0.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide (CID 70598948) is 2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide is CC(=O)NCC(=O)NC1=NCCS1.
What is the InChIKey of 2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide?
The InChIKey is WZZQVDWDHXIXST-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2S/c1-5(11)9-4-6(12)10-7-8-2-3-13-7/h2-4H2,1H3,(H,9,11)(H,8,10,12).
What are the key properties of 2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide?
2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide has a molecular weight of 201.25 g/mol, XLogP of -0.66, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 70598948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).