2-acetamido-2-(1,3-thiazol-2-yl)acetamide

C7H9N3O2S — CID 123240076

IUPAC2-acetamido-2-(1,3-thiazol-2-yl)acetamide
SMILESCC(=O)NC(C(N)=O)c1nccs1
InChIInChI=1S/C7H9N3O2S/c1-4(11)10-5(6(8)12)7-9-2-3-13-7/h2-3,5H,1H3,(H2,8,12)(H,10,11)
InChIKeyICXVMQXOJJOQPK-UHFFFAOYSA-N
MW199.24 g/mol
LogP-0.19
Rot. Bonds3

About 2-acetamido-2-(1,3-thiazol-2-yl)acetamide

2-acetamido-2-(1,3-thiazol-2-yl)acetamide (PubChem CID 123240076) has the molecular formula C7H9N3O2S and a molecular weight of 199.24 g/mol. Its IUPAC name is 2-acetamido-2-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-acetamido-2-(1,3-thiazol-2-yl)acetamide
PubChem CID123240076
Molecular FormulaC7H9N3O2S
Molecular Weight199.24 g/mol
Exact Mass199.04
IUPAC Name2-acetamido-2-(1,3-thiazol-2-yl)acetamide
SMILESCC(=O)NC(C(N)=O)c1nccs1
InChIInChI=1S/C7H9N3O2S/c1-4(11)10-5(6(8)12)7-9-2-3-13-7/h2-3,5H,1H3,(H2,8,12)(H,10,11)
InChIKeyICXVMQXOJJOQPK-UHFFFAOYSA-N
XLogP-0.19
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.24
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-Oxo-4-(1,3-thiazol-2-yl)pyrrolidin-1-yl]butanamide
CID 9943002
N-propan-2-yl-2-[2-(1,3-thiazol-2-yl)butan-2-ylamino]acetamide
CID 71868950
2-[2-(1,3-Thiazol-2-yl)butan-2-ylamino]acetamide
CID 71868956
5-Methyl-5-(1,3-thiazol-2-yl)imidazolidine-2,4-dione
CID 64990799
N-methyl thiazol-2-ylacetamide
CID 11073663
Thiazol-2-yl-acetamide
CID 19875792
Thiazolylmalonamide
CID 19940076
N-tert-butyl-2-[2-(1,3-thiazol-2-yl)propan-2-ylamino]acetamide
CID 71986837
1-(2-Oxo-2-pyrrolidin-1-ylethyl)-3-[1-(1,3-thiazol-2-yl)propyl]urea
CID 72006421
4-(acetylamino)-N-methyl-N-(1,3-thiazol-2-ylmethyl)butanamide
CID 86285742
(2S)-2-[methyl(1,3-thiazol-2-ylmethyl)amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 97237746
(2S)-2-(2,2-dimethylpropanoylamino)-N,4-dimethyl-N-[2-(1,3-thiazol-2-yl)ethyl]pentanamide
CID 122151537

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-2-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-acetamido-2-(1,3-thiazol-2-yl)acetamide (CID 123240076) is 2-acetamido-2-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-acetamido-2-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-acetamido-2-(1,3-thiazol-2-yl)acetamide is CC(=O)NC(C(N)=O)c1nccs1.
What is the InChIKey of 2-acetamido-2-(1,3-thiazol-2-yl)acetamide?
The InChIKey is ICXVMQXOJJOQPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2S/c1-4(11)10-5(6(8)12)7-9-2-3-13-7/h2-3,5H,1H3,(H2,8,12)(H,10,11).
What are the key properties of 2-acetamido-2-(1,3-thiazol-2-yl)acetamide?
2-acetamido-2-(1,3-thiazol-2-yl)acetamide has a molecular weight of 199.24 g/mol, XLogP of -0.19, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-2-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 123240076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).