N-methyl-N-[2-(4-phenylthiadiazol-5-yl)oxyphenyl]acetamide

C17H15N3O2S — CID 67929192

IUPACN-methyl-N-[2-(4-phenylthiadiazol-5-yl)oxyphenyl]acetamide
SMILESCC(=O)N(C)c1ccccc1Oc1snnc1-c1ccccc1
InChIInChI=1S/C17H15N3O2S/c1-12(21)20(2)14-10-6-7-11-15(14)22-17-16(18-19-23-17)13-8-4-3-5-9-13/h3-11H,1-2H3
InChIKeyJITCKZFUFUIPLZ-UHFFFAOYSA-N
MW325.39 g/mol
LogP3.98
Rot. Bonds4

About N-methyl-N-[2-(4-phenylthiadiazol-5-yl)oxyphenyl]acetamide

N-methyl-N-[2-(4-phenylthiadiazol-5-yl)oxyphenyl]acetamide (PubChem CID 67929192) has the molecular formula C17H15N3O2S and a molecular weight of 325.39 g/mol. Its IUPAC name is N-methyl-N-[2-(4-phenylthiadiazol-5-yl)oxyphenyl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[2-(4-phenylthiadiazol-5-yl)oxyphenyl]acetamide
PubChem CID67929192
Molecular FormulaC17H15N3O2S
Molecular Weight325.39 g/mol
Exact Mass325.09
IUPAC NameN-methyl-N-[2-(4-phenylthiadiazol-5-yl)oxyphenyl]acetamide
SMILESCC(=O)N(C)c1ccccc1Oc1snnc1-c1ccccc1
InChIInChI=1S/C17H15N3O2S/c1-12(21)20(2)14-10-6-7-11-15(14)22-17-16(18-19-23-17)13-8-4-3-5-9-13/h3-11H,1-2H3
InChIKeyJITCKZFUFUIPLZ-UHFFFAOYSA-N
XLogP3.98
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.39
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(4-phenylthiadiazol-5-yl)oxyphenyl]acetamide?
The IUPAC name of N-methyl-N-[2-(4-phenylthiadiazol-5-yl)oxyphenyl]acetamide (CID 67929192) is N-methyl-N-[2-(4-phenylthiadiazol-5-yl)oxyphenyl]acetamide.
What is the SMILES notation for N-methyl-N-[2-(4-phenylthiadiazol-5-yl)oxyphenyl]acetamide?
The canonical SMILES for N-methyl-N-[2-(4-phenylthiadiazol-5-yl)oxyphenyl]acetamide is CC(=O)N(C)c1ccccc1Oc1snnc1-c1ccccc1.
What is the InChIKey of N-methyl-N-[2-(4-phenylthiadiazol-5-yl)oxyphenyl]acetamide?
The InChIKey is JITCKZFUFUIPLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2S/c1-12(21)20(2)14-10-6-7-11-15(14)22-17-16(18-19-23-17)13-8-4-3-5-9-13/h3-11H,1-2H3.
What are the key properties of N-methyl-N-[2-(4-phenylthiadiazol-5-yl)oxyphenyl]acetamide?
N-methyl-N-[2-(4-phenylthiadiazol-5-yl)oxyphenyl]acetamide has a molecular weight of 325.39 g/mol, XLogP of 3.98, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(4-phenylthiadiazol-5-yl)oxyphenyl]acetamide is sourced from PubChem (CID 67929192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).