N-methyl-2-phenoxy-2-(thiadiazol-4-yl)acetamide

C11H11N3O2S — CID 23248313

IUPACN-methyl-2-phenoxy-2-(thiadiazol-4-yl)acetamide
SMILESCNC(=O)C(Oc1ccccc1)c1csnn1
InChIInChI=1S/C11H11N3O2S/c1-12-11(15)10(9-7-17-14-13-9)16-8-5-3-2-4-6-8/h2-7,10H,1H3,(H,12,15)
InChIKeyUFNISPOAWKTQMK-UHFFFAOYSA-N
MW249.30 g/mol
LogP1.40
Rot. Bonds4

About N-methyl-2-phenoxy-2-(thiadiazol-4-yl)acetamide

N-methyl-2-phenoxy-2-(thiadiazol-4-yl)acetamide (PubChem CID 23248313) has the molecular formula C11H11N3O2S and a molecular weight of 249.30 g/mol. Its IUPAC name is N-methyl-2-phenoxy-2-(thiadiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-methyl-2-phenoxy-2-(thiadiazol-4-yl)acetamide
PubChem CID23248313
Molecular FormulaC11H11N3O2S
Molecular Weight249.30 g/mol
Exact Mass249.06
IUPAC NameN-methyl-2-phenoxy-2-(thiadiazol-4-yl)acetamide
SMILESCNC(=O)C(Oc1ccccc1)c1csnn1
InChIInChI=1S/C11H11N3O2S/c1-12-11(15)10(9-7-17-14-13-9)16-8-5-3-2-4-6-8/h2-7,10H,1H3,(H,12,15)
InChIKeyUFNISPOAWKTQMK-UHFFFAOYSA-N
XLogP1.40
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.30
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-2-phenoxypropanamide
CID 4626974
2-chloro-N-phenyl-2-(thiadiazol-4-yl)acetamide
CID 141393287
2-methoxy-N-methyl-2-phenoxyacetamide
CID 69350030
2-(methylamino)-2-phenoxyacetic acid
CID 150857951
N-methyl-2-(2-methylphenyl)-1-(thiadiazol-4-yl)ethanamine
CID 105091515
2-phenoxypropanoic acid;hydrofluoride
CID 161153787
N-pentan-3-yl-2-phenoxy-2-phenylacetamide
CID 55752773
benzhydryl thiadiazole-4-carboxylate
CID 57265234
2-(2-phenoxypropanoylamino)propanoic acid
CID 43092023
(2S)-2-phenoxy-N-(1,3,4-thiadiazol-2-yl)propanamide
CID 936294
N-methyl-2-(thiadiazol-4-ylmethylamino)propanamide
CID 61464284
(2S)-2-phenoxy-N-pyridin-4-ylpropanamide
CID 670007

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-phenoxy-2-(thiadiazol-4-yl)acetamide?
The IUPAC name of N-methyl-2-phenoxy-2-(thiadiazol-4-yl)acetamide (CID 23248313) is N-methyl-2-phenoxy-2-(thiadiazol-4-yl)acetamide.
What is the SMILES notation for N-methyl-2-phenoxy-2-(thiadiazol-4-yl)acetamide?
The canonical SMILES for N-methyl-2-phenoxy-2-(thiadiazol-4-yl)acetamide is CNC(=O)C(Oc1ccccc1)c1csnn1.
What is the InChIKey of N-methyl-2-phenoxy-2-(thiadiazol-4-yl)acetamide?
The InChIKey is UFNISPOAWKTQMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2S/c1-12-11(15)10(9-7-17-14-13-9)16-8-5-3-2-4-6-8/h2-7,10H,1H3,(H,12,15).
What are the key properties of N-methyl-2-phenoxy-2-(thiadiazol-4-yl)acetamide?
N-methyl-2-phenoxy-2-(thiadiazol-4-yl)acetamide has a molecular weight of 249.30 g/mol, XLogP of 1.40, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-phenoxy-2-(thiadiazol-4-yl)acetamide is sourced from PubChem (CID 23248313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).