2-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide

C15H13N3O3S — CID 75390973

IUPAC2-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide
SMILESNC(=O)Cc1ccccc1OCc1nnc(-c2cccs2)o1
InChIInChI=1S/C15H13N3O3S/c16-13(19)8-10-4-1-2-5-11(10)20-9-14-17-18-15(21-14)12-6-3-7-22-12/h1-7H,8-9H2,(H2,16,19)
InChIKeyPHKAZKPURLVINY-UHFFFAOYSA-N
MW315.35 g/mol
LogP2.40
Rot. Bonds6

About 2-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide

2-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide (PubChem CID 75390973) has the molecular formula C15H13N3O3S and a molecular weight of 315.35 g/mol. Its IUPAC name is 2-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide.

Molecular Properties

Compound Name2-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide
PubChem CID75390973
Molecular FormulaC15H13N3O3S
Molecular Weight315.35 g/mol
Exact Mass315.07
IUPAC Name2-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide
SMILESNC(=O)Cc1ccccc1OCc1nnc(-c2cccs2)o1
InChIInChI=1S/C15H13N3O3S/c16-13(19)8-10-4-1-2-5-11(10)20-9-14-17-18-15(21-14)12-6-3-7-22-12/h1-7H,8-9H2,(H2,16,19)
InChIKeyPHKAZKPURLVINY-UHFFFAOYSA-N
XLogP2.40
TPSA91.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.35
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl 1-oxidopyridin-1-ium-4-carboxylate
CID 8792206
1-[3-methoxy-4-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]ethanone
CID 17443233
2-(methoxymethyl)-5-thiophen-2-yl-1,3,4-oxadiazole
CID 53017470
(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol
CID 43558918
benzyl N-[2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]carbamate
CID 110322483
2-tert-butyl-4-chloro-5-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]pyridazin-3-one
CID 11257118
2-(phthalazin-1-yloxymethyl)-5-thiophen-2-yl-1,3,4-oxadiazole
CID 4880151
(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl 1H-indazole-3-carboxylate
CID 2651720
N,N-dimethyl-1-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-1-yl]methanamine
CID 4827439
(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl 2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate
CID 41148663
2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methylsulfanyl]benzoic acid
CID 43092573
2,6-dimethyl-4-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]pyridine-3-carbonitrile
CID 75431420

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide?
The IUPAC name of 2-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide (CID 75390973) is 2-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide.
What is the SMILES notation for 2-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide?
The canonical SMILES for 2-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide is NC(=O)Cc1ccccc1OCc1nnc(-c2cccs2)o1.
What is the InChIKey of 2-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide?
The InChIKey is PHKAZKPURLVINY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O3S/c16-13(19)8-10-4-1-2-5-11(10)20-9-14-17-18-15(21-14)12-6-3-7-22-12/h1-7H,8-9H2,(H2,16,19).
What are the key properties of 2-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide?
2-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide has a molecular weight of 315.35 g/mol, XLogP of 2.40, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide is sourced from PubChem (CID 75390973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).