N,N-dimethyl-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)oxy]benzamide

C17H15N3O2S — CID 122144873

IUPACN,N-dimethyl-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)oxy]benzamide
SMILESCN(C)C(=O)c1cccc(Oc2nc(-c3ccccc3)ns2)c1
InChIInChI=1S/C17H15N3O2S/c1-20(2)16(21)13-9-6-10-14(11-13)22-17-18-15(19-23-17)12-7-4-3-5-8-12/h3-11H,1-2H3
InChIKeyBNXLDLVIPBKFOZ-UHFFFAOYSA-N
MW325.39 g/mol
LogP3.70
Rot. Bonds4

About N,N-dimethyl-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)oxy]benzamide

N,N-dimethyl-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)oxy]benzamide (PubChem CID 122144873) has the molecular formula C17H15N3O2S and a molecular weight of 325.39 g/mol. Its IUPAC name is N,N-dimethyl-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)oxy]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)oxy]benzamide
PubChem CID122144873
Molecular FormulaC17H15N3O2S
Molecular Weight325.39 g/mol
Exact Mass325.09
IUPAC NameN,N-dimethyl-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)oxy]benzamide
SMILESCN(C)C(=O)c1cccc(Oc2nc(-c3ccccc3)ns2)c1
InChIInChI=1S/C17H15N3O2S/c1-20(2)16(21)13-9-6-10-14(11-13)22-17-18-15(19-23-17)12-7-4-3-5-8-12/h3-11H,1-2H3
InChIKeyBNXLDLVIPBKFOZ-UHFFFAOYSA-N
XLogP3.70
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 ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(6-fluoro-2-pyridinyl)oxy]-N,N-dimethylbenzamide
CID 23441684
5-(3,5-dichlorophenoxy)-3-phenyl-1,2,4-thiadiazole
CID 2725978
N,N-dimethyl-3-phenylmethoxybenzamide
CID 8778645
3-(4-amino-3-chlorophenoxy)-N,N-dimethylbenzamide
CID 118138252
3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)oxy]benzoic acid
CID 62861962
N,N-dimethyl-3-propoxybenzamide
CID 28639811
3-[[4-[[3-(dimethylcarbamoyl)phenoxy]methyl]phenyl]methoxy]-N,N-dimethylbenzamide
CID 167758770
1-(dimethylcarbamoyl)-3-fluorosulfonyloxybenzene
CID 154880190
3-(1H-benzimidazol-2-yl)-N,N-dimethylbenzamide
CID 168555256
N-[3-(3-methoxyphenyl)-1,2,4-thiadiazol-5-yl]benzamide
CID 52904761
N-benzhydryl-3-[[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]oxy]benzamide
CID 3259414
N,N-dimethyl-3-[(4-oxo-1-phenyl-5H-pyrazolo[5,4-d]pyrimidin-6-yl)oxy]benzamide
CID 137258332

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)oxy]benzamide?
The IUPAC name of N,N-dimethyl-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)oxy]benzamide (CID 122144873) is N,N-dimethyl-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)oxy]benzamide.
What is the SMILES notation for N,N-dimethyl-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)oxy]benzamide?
The canonical SMILES for N,N-dimethyl-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)oxy]benzamide is CN(C)C(=O)c1cccc(Oc2nc(-c3ccccc3)ns2)c1.
What is the InChIKey of N,N-dimethyl-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)oxy]benzamide?
The InChIKey is BNXLDLVIPBKFOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2S/c1-20(2)16(21)13-9-6-10-14(11-13)22-17-18-15(19-23-17)12-7-4-3-5-8-12/h3-11H,1-2H3.
What are the key properties of N,N-dimethyl-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)oxy]benzamide?
N,N-dimethyl-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)oxy]benzamide has a molecular weight of 325.39 g/mol, XLogP of 3.70, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)oxy]benzamide is sourced from PubChem (CID 122144873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).