2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide

C12H19N3OS — CID 113267211

IUPAC2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide
SMILESCCc1cnc(C(C)NC(=O)CC2CNC2)s1
InChIInChI=1S/C12H19N3OS/c1-3-10-7-14-12(17-10)8(2)15-11(16)4-9-5-13-6-9/h7-9,13H,3-6H2,1-2H3,(H,15,16)
InChIKeyMRYJEGBUYFKKPK-UHFFFAOYSA-N
MW253.37 g/mol
LogP1.49
Rot. Bonds5

About 2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide

2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide (PubChem CID 113267211) has the molecular formula C12H19N3OS and a molecular weight of 253.37 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide
PubChem CID113267211
Molecular FormulaC12H19N3OS
Molecular Weight253.37 g/mol
Exact Mass253.12
IUPAC Name2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide
SMILESCCc1cnc(C(C)NC(=O)CC2CNC2)s1
InChIInChI=1S/C12H19N3OS/c1-3-10-7-14-12(17-10)8(2)15-11(16)4-9-5-13-6-9/h7-9,13H,3-6H2,1-2H3,(H,15,16)
InChIKeyMRYJEGBUYFKKPK-UHFFFAOYSA-N
XLogP1.49
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.37
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1R)-1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-2-piperidin-4-ylacetamide
CID 124576184
N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-2-piperidin-4-ylsulfanylacetamide
CID 114627994
2-(1-aminocyclobutyl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide
CID 112701971
2-(azetidin-3-yl)-N-[(1S)-1-pyridin-2-ylethyl]acetamide
CID 81406682
N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-2-methylpiperidine-4-carboxamide
CID 106740581
1-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-3-[(2S)-2-hydroxypropyl]urea
CID 102563246
N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-2-(2-hydroxyphenyl)acetamide
CID 115679370
(2R)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide
CID 113264319
1-[(1S)-1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-3-[[(1R,3S)-3-hydroxycyclopentyl]methyl]urea
CID 99792957
N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-2,2,2-trifluoroacetamide
CID 112696819
2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]propan-1-amine
CID 116680390
1-(5-ethyl-1,3-thiazol-2-yl)-N-(2-pyrrolidin-3-ylethyl)ethanamine
CID 113387356

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide?
The IUPAC name of 2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide (CID 113267211) is 2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide is CCc1cnc(C(C)NC(=O)CC2CNC2)s1.
What is the InChIKey of 2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide?
The InChIKey is MRYJEGBUYFKKPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3OS/c1-3-10-7-14-12(17-10)8(2)15-11(16)4-9-5-13-6-9/h7-9,13H,3-6H2,1-2H3,(H,15,16).
What are the key properties of 2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide?
2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide has a molecular weight of 253.37 g/mol, XLogP of 1.49, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 113267211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).