N-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)acetamide

C10H13N3O2S — CID 64612276

IUPACN-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)acetamide
SMILESCC(=O)c1csc(NC(=O)CC2CNC2)n1
InChIInChI=1S/C10H13N3O2S/c1-6(14)8-5-16-10(12-8)13-9(15)2-7-3-11-4-7/h5,7,11H,2-4H2,1H3,(H,12,13,15)
InChIKeyUYLUGXJULKZNMV-UHFFFAOYSA-N
MW239.30 g/mol
LogP0.89
Rot. Bonds4

About N-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)acetamide

N-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)acetamide (PubChem CID 64612276) has the molecular formula C10H13N3O2S and a molecular weight of 239.30 g/mol. Its IUPAC name is N-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)acetamide
PubChem CID64612276
Molecular FormulaC10H13N3O2S
Molecular Weight239.30 g/mol
Exact Mass239.07
IUPAC NameN-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)acetamide
SMILESCC(=O)c1csc(NC(=O)CC2CNC2)n1
InChIInChI=1S/C10H13N3O2S/c1-6(14)8-5-16-10(12-8)13-9(15)2-7-3-11-4-7/h5,7,11H,2-4H2,1H3,(H,12,13,15)
InChIKeyUYLUGXJULKZNMV-UHFFFAOYSA-N
XLogP0.89
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.30
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-acetyl-1,3-thiazol-2-yl)-2-cycloheptylacetamide
CID 115681438
N-(4-acetyl-1,3-thiazol-2-yl)-2-cyclohexylacetamide
CID 60717010
N-(4-acetyl-1,3-thiazol-2-yl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide
CID 79615397
N-(4-acetyl-1,3-thiazol-2-yl)-3-piperidin-3-ylpropanamide
CID 64555532
N-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)propanamide
CID 116678104
N-(4-acetyl-1,3-thiazol-2-yl)-3-cyclohexylpropanamide
CID 24634046
2-cyclopentyl-N-[4-(N-hydroxy-C-methylcarbonimidoyl)-1,3-thiazol-2-yl]acetamide
CID 77047021
N-[4-(N-hydroxy-C-methylcarbonimidoyl)-1,3-thiazol-2-yl]-2-(thian-4-yl)acetamide
CID 83136336
N-(4-acetyl-1,3-thiazol-2-yl)-4-aminobutanamide
CID 64556533
N-(4-acetyl-1,3-thiazol-2-yl)decanamide
CID 60729978
N-(4-acetyl-1,3-thiazol-2-yl)-4-methylpiperidine-4-carboxamide
CID 64557119
N-(4-acetyl-1,3-thiazol-2-yl)-4-ethylpiperidine-2-carboxamide
CID 114429119

Frequently Asked Questions

What is the IUPAC name of N-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)acetamide?
The IUPAC name of N-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)acetamide (CID 64612276) is N-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)acetamide.
What is the SMILES notation for N-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)acetamide?
The canonical SMILES for N-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)acetamide is CC(=O)c1csc(NC(=O)CC2CNC2)n1.
What is the InChIKey of N-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)acetamide?
The InChIKey is UYLUGXJULKZNMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2S/c1-6(14)8-5-16-10(12-8)13-9(15)2-7-3-11-4-7/h5,7,11H,2-4H2,1H3,(H,12,13,15).
What are the key properties of N-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)acetamide?
N-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)acetamide has a molecular weight of 239.30 g/mol, XLogP of 0.89, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetyl-1,3-thiazol-2-yl)-2-(azetidin-3-yl)acetamide is sourced from PubChem (CID 64612276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).