2-cyclohexyl-6-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzamide

C19H19N3O2S — CID 175980064

IUPAC2-cyclohexyl-6-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzamide
SMILESNC(=O)c1c(-c2nnc(-c3cccs3)o2)cccc1C1CCCCC1
InChIInChI=1S/C19H19N3O2S/c20-17(23)16-13(12-6-2-1-3-7-12)8-4-9-14(16)18-21-22-19(24-18)15-10-5-11-25-15/h4-5,8-12H,1-3,6-7H2,(H2,20,23)
InChIKeyYONFLRCROFFWSL-UHFFFAOYSA-N
MW353.45 g/mol
LogP4.61
Rot. Bonds4

About 2-cyclohexyl-6-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzamide

2-cyclohexyl-6-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzamide (PubChem CID 175980064) has the molecular formula C19H19N3O2S and a molecular weight of 353.45 g/mol. Its IUPAC name is 2-cyclohexyl-6-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-cyclohexyl-6-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzamide
PubChem CID175980064
Molecular FormulaC19H19N3O2S
Molecular Weight353.45 g/mol
Exact Mass353.12
IUPAC Name2-cyclohexyl-6-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzamide
SMILESNC(=O)c1c(-c2nnc(-c3cccs3)o2)cccc1C1CCCCC1
InChIInChI=1S/C19H19N3O2S/c20-17(23)16-13(12-6-2-1-3-7-12)8-4-9-14(16)18-21-22-19(24-18)15-10-5-11-25-15/h4-5,8-12H,1-3,6-7H2,(H2,20,23)
InChIKeyYONFLRCROFFWSL-UHFFFAOYSA-N
XLogP4.61
TPSA82.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.45
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3-fluorophenyl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
CID 110243077
1-cyclopentyl-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)urea
CID 52906577
(4-fluorophenyl)-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
CID 93492617
furan-2-yl-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
CID 30863498
5-thiophen-2-yl-1,3,4-oxadiazol-2-amine
CID 16767328
2-methyl-1-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-1-one
CID 51895985
(3S)-N-ethyl-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide
CID 51896006
(2-methylphenyl)-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
CID 95849840
(4-phenylphenyl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
CID 121068824
(3,5-dimethylphenyl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
CID 121068792
(3-methoxyphenyl)-[(3R)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
CID 95849844
naphthalen-2-yl-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
CID 121068822

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-6-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzamide?
The IUPAC name of 2-cyclohexyl-6-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzamide (CID 175980064) is 2-cyclohexyl-6-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzamide.
What is the SMILES notation for 2-cyclohexyl-6-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzamide?
The canonical SMILES for 2-cyclohexyl-6-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzamide is NC(=O)c1c(-c2nnc(-c3cccs3)o2)cccc1C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-6-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzamide?
The InChIKey is YONFLRCROFFWSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2S/c20-17(23)16-13(12-6-2-1-3-7-12)8-4-9-14(16)18-21-22-19(24-18)15-10-5-11-25-15/h4-5,8-12H,1-3,6-7H2,(H2,20,23).
What are the key properties of 2-cyclohexyl-6-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzamide?
2-cyclohexyl-6-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzamide has a molecular weight of 353.45 g/mol, XLogP of 4.61, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-6-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)benzamide is sourced from PubChem (CID 175980064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).