N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide

C18H13N3O3S — CID 1073872

IUPACN-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)Nc1ccc(-c2nnc(-c3ccco3)o2)cc1
InChIInChI=1S/C18H13N3O3S/c22-16(11-14-3-2-10-25-14)19-13-7-5-12(6-8-13)17-20-21-18(24-17)15-4-1-9-23-15/h1-10H,11H2,(H,19,22)
InChIKeyMLWPYFCQQKEUSC-UHFFFAOYSA-N
MW351.39 g/mol
LogP4.24
Rot. Bonds5

About N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide

N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide (PubChem CID 1073872) has the molecular formula C18H13N3O3S and a molecular weight of 351.39 g/mol. Its IUPAC name is N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide
PubChem CID1073872
Molecular FormulaC18H13N3O3S
Molecular Weight351.39 g/mol
Exact Mass351.07
IUPAC NameN-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)Nc1ccc(-c2nnc(-c3ccco3)o2)cc1
InChIInChI=1S/C18H13N3O3S/c22-16(11-14-3-2-10-25-14)19-13-7-5-12(6-8-13)17-20-21-18(24-17)15-4-1-9-23-15/h1-10H,11H2,(H,19,22)
InChIKeyMLWPYFCQQKEUSC-UHFFFAOYSA-N
XLogP4.24
TPSA81.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.39
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-3-methoxybenzamide
CID 661009
Methyl 3-[({[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetyl)amino]benzoate
CID 1160631
N-{4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl}-2,2-diphenylacetamide
CID 1038406
N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-(4-methylphenyl)sulfanylacetamide
CID 2200770
N-(4-ethylphenyl)-2-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide
CID 691759
4-[4-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]anilino]-4-oxobutanoic acid
CID 738066
4-(5-Furan-2-yl-[1,3,4]oxadiazol-2-ylsulfanylmethyl)-1H-quinolin-2-one
CID 644640
N-(4-(5-(furan-2-yl)-1,3,4-oxadiazol-2-yl)phenyl)-2-phenoxyacetamide
CID 660304
N-(2,5-dimethylphenyl)-2-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide
CID 865354
N-(4-(5-(furan-2-yl)-1,3,4-oxadiazol-2-yl)phenyl)-2-(2-methoxyphenoxy)acetamide
CID 1167557
N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-(4-methylphenyl)sulfanylacetamide
CID 1288829
N-[4-[5-(2-furanyl)-1,3,4-oxadiazol-2-yl]phenyl]-2-(2-methoxyphenyl)acetamide
CID 1339710

Frequently Asked Questions

What is the IUPAC name of N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide?
The IUPAC name of N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide (CID 1073872) is N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide is O=C(Cc1cccs1)Nc1ccc(-c2nnc(-c3ccco3)o2)cc1.
What is the InChIKey of N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide?
The InChIKey is MLWPYFCQQKEUSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N3O3S/c22-16(11-14-3-2-10-25-14)19-13-7-5-12(6-8-13)17-20-21-18(24-17)15-4-1-9-23-15/h1-10H,11H2,(H,19,22).
What are the key properties of N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide?
N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide has a molecular weight of 351.39 g/mol, XLogP of 4.24, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 1073872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).