2-(2-methylphenoxy)-N-(thiatriazol-5-yl)acetamide

C10H10N4O2S — CID 19114261

IUPAC2-(2-methylphenoxy)-N-(thiatriazol-5-yl)acetamide
SMILESCc1ccccc1OCC(=O)Nc1nnns1
InChIInChI=1S/C10H10N4O2S/c1-7-4-2-3-5-8(7)16-6-9(15)11-10-12-13-14-17-10/h2-5H,6H2,1H3,(H,11,12,14,15)
InChIKeySZDCLWQHIKJDCD-UHFFFAOYSA-N
MW250.28 g/mol
LogP1.26
Rot. Bonds4

About 2-(2-methylphenoxy)-N-(thiatriazol-5-yl)acetamide

2-(2-methylphenoxy)-N-(thiatriazol-5-yl)acetamide (PubChem CID 19114261) has the molecular formula C10H10N4O2S and a molecular weight of 250.28 g/mol. Its IUPAC name is 2-(2-methylphenoxy)-N-(thiatriazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(2-methylphenoxy)-N-(thiatriazol-5-yl)acetamide
PubChem CID19114261
Molecular FormulaC10H10N4O2S
Molecular Weight250.28 g/mol
Exact Mass250.05
IUPAC Name2-(2-methylphenoxy)-N-(thiatriazol-5-yl)acetamide
SMILESCc1ccccc1OCC(=O)Nc1nnns1
InChIInChI=1S/C10H10N4O2S/c1-7-4-2-3-5-8(7)16-6-9(15)11-10-12-13-14-17-10/h2-5H,6H2,1H3,(H,11,12,14,15)
InChIKeySZDCLWQHIKJDCD-UHFFFAOYSA-N
XLogP1.26
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.28
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2,6-dimethylphenoxy)-N-(thiatriazol-5-yl)acetamide
CID 19114282
2-(4-chloro-3,5-dimethylphenoxy)-N-(thiatriazol-5-yl)acetamide
CID 19114305
2-(4-fluorophenoxy)-N-(thiatriazol-5-yl)acetamide
CID 19114256
2-(2,4-dichlorophenoxy)-N-(thiatriazol-5-yl)acetamide
CID 19114260
2-(4-tert-butylphenoxy)-N-(thiatriazol-5-yl)acetamide
CID 19114306
methyl 4-methyl-2-[[2-(2-methylphenoxy)acetyl]amino]-1,3-thiazole-5-carboxylate
CID 3146505
2-(2-methylphenoxy)-N-[3-(5-methylthiophen-2-yl)-1,2,4-thiadiazol-5-yl]acetamide
CID 39834848
2-(2-methylphenoxy)-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide
CID 19217708
2-(2-methylphenoxy)-N-pyridin-4-ylacetamide
CID 1101312
2-[2-(thiatriazol-5-ylcarbamoylamino)phenoxy]acetic acid
CID 114913435
2-(3-aminophenoxy)-N-(thiatriazol-5-yl)acetamide
CID 114911560
N-(5-benzyl-1,3-thiazol-2-yl)-2-(2-methylphenoxy)acetamide
CID 23760784

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenoxy)-N-(thiatriazol-5-yl)acetamide?
The IUPAC name of 2-(2-methylphenoxy)-N-(thiatriazol-5-yl)acetamide (CID 19114261) is 2-(2-methylphenoxy)-N-(thiatriazol-5-yl)acetamide.
What is the SMILES notation for 2-(2-methylphenoxy)-N-(thiatriazol-5-yl)acetamide?
The canonical SMILES for 2-(2-methylphenoxy)-N-(thiatriazol-5-yl)acetamide is Cc1ccccc1OCC(=O)Nc1nnns1.
What is the InChIKey of 2-(2-methylphenoxy)-N-(thiatriazol-5-yl)acetamide?
The InChIKey is SZDCLWQHIKJDCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2S/c1-7-4-2-3-5-8(7)16-6-9(15)11-10-12-13-14-17-10/h2-5H,6H2,1H3,(H,11,12,14,15).
What are the key properties of 2-(2-methylphenoxy)-N-(thiatriazol-5-yl)acetamide?
2-(2-methylphenoxy)-N-(thiatriazol-5-yl)acetamide has a molecular weight of 250.28 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenoxy)-N-(thiatriazol-5-yl)acetamide is sourced from PubChem (CID 19114261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).