2-[(5-cyano-4-methyl-1,3-thiazol-2-yl)oxy]acetamide

C7H7N3O2S — CID 139747139

IUPAC2-[(5-cyano-4-methyl-1,3-thiazol-2-yl)oxy]acetamide
SMILESCc1nc(OCC(N)=O)sc1C#N
InChIInChI=1S/C7H7N3O2S/c1-4-5(2-8)13-7(10-4)12-3-6(9)11/h3H2,1H3,(H2,9,11)
InChIKeyAOIUDPLRXJZEJU-UHFFFAOYSA-N
MW197.22 g/mol
LogP0.19
Rot. Bonds3

About 2-[(5-cyano-4-methyl-1,3-thiazol-2-yl)oxy]acetamide

2-[(5-cyano-4-methyl-1,3-thiazol-2-yl)oxy]acetamide (PubChem CID 139747139) has the molecular formula C7H7N3O2S and a molecular weight of 197.22 g/mol. Its IUPAC name is 2-[(5-cyano-4-methyl-1,3-thiazol-2-yl)oxy]acetamide.

Molecular Properties

Compound Name2-[(5-cyano-4-methyl-1,3-thiazol-2-yl)oxy]acetamide
PubChem CID139747139
Molecular FormulaC7H7N3O2S
Molecular Weight197.22 g/mol
Exact Mass197.03
IUPAC Name2-[(5-cyano-4-methyl-1,3-thiazol-2-yl)oxy]acetamide
SMILESCc1nc(OCC(N)=O)sc1C#N
InChIInChI=1S/C7H7N3O2S/c1-4-5(2-8)13-7(10-4)12-3-6(9)11/h3H2,1H3,(H2,9,11)
InChIKeyAOIUDPLRXJZEJU-UHFFFAOYSA-N
XLogP0.19
TPSA89.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.22
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-4-methyl-1,3-thiazole-5-carbonitrile
CID 82651754
2-[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridinyl]oxy]acetamide
CID 1229880
2-(3,5-dicyano-4-methylphenoxy)acetamide
CID 70807805
4-chloro-2-ethoxy-1,3-thiazole-5-carbonitrile
CID 130580627
N-[4-[(5-cyano-4-methyl-1,3-thiazol-2-yl)methoxy]phenyl]acetamide
CID 86191154
4-(2-amino-4-methyl-1,3-thiazol-5-yl)but-3-ynamide
CID 170472466
2-[(6-methyl-2-pyridinyl)oxy]acetamide
CID 22228306
4,5-dicyano-1,3-thiazole-2-carboxamide
CID 102300920
2-amino-N-(2-amino-2-oxoethoxy)-4-methyl-1,3-thiazole-5-carboxamide
CID 112674174
2-[(4-ethylphenoxy)methyl]-4-methyl-1,3-thiazole-5-carbonitrile
CID 82426009
4-methylthiadiazole-5-carbonitrile;4-methylthiadiazole-5-carboxamide
CID 90690649
ethyl 2-[(4-chloro-5-cyano-1,3-thiazol-2-yl)amino]acetate
CID 3851603

Frequently Asked Questions

What is the IUPAC name of 2-[(5-cyano-4-methyl-1,3-thiazol-2-yl)oxy]acetamide?
The IUPAC name of 2-[(5-cyano-4-methyl-1,3-thiazol-2-yl)oxy]acetamide (CID 139747139) is 2-[(5-cyano-4-methyl-1,3-thiazol-2-yl)oxy]acetamide.
What is the SMILES notation for 2-[(5-cyano-4-methyl-1,3-thiazol-2-yl)oxy]acetamide?
The canonical SMILES for 2-[(5-cyano-4-methyl-1,3-thiazol-2-yl)oxy]acetamide is Cc1nc(OCC(N)=O)sc1C#N.
What is the InChIKey of 2-[(5-cyano-4-methyl-1,3-thiazol-2-yl)oxy]acetamide?
The InChIKey is AOIUDPLRXJZEJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O2S/c1-4-5(2-8)13-7(10-4)12-3-6(9)11/h3H2,1H3,(H2,9,11).
What are the key properties of 2-[(5-cyano-4-methyl-1,3-thiazol-2-yl)oxy]acetamide?
2-[(5-cyano-4-methyl-1,3-thiazol-2-yl)oxy]acetamide has a molecular weight of 197.22 g/mol, XLogP of 0.19, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-cyano-4-methyl-1,3-thiazol-2-yl)oxy]acetamide is sourced from PubChem (CID 139747139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).