8AE

4-(cyclobutylmethoxy)benzamide

Created:	2021-10-07
Last modified:	2022-08-22

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1 entries where 8AE is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	30
Chiral Atom Count	0
Bond Count	31
Aromatic Bond Count	6

2D diagram of 8AE

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Chemical Component Summary
Name	4-(cyclobutylmethoxy)benzamide
Systematic Name (OpenEye OEToolkits)	4-(cyclobutylmethoxy)benzamide
Formula	C₁₂ H₁₅ N O₂
Molecular Weight	205.253
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	NC(=O)c1ccc(OCC2CCC2)cc1
SMILES	OpenEye OEToolkits	2.0.7	c1cc(ccc1C(=O)N)OCC2CCC2
Canonical SMILES	CACTVS	3.385	NC(=O)c1ccc(OCC2CCC2)cc1
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1cc(ccc1C(=O)N)OCC2CCC2
InChI	InChI	1.06	InChI=1S/C12H15NO2/c13-12(14)10-4-6-11(7-5-10)15-8-9-2-1-3-9/h4-7,9H,1-3,8H2,(H2,13,14)
InChIKey	InChI	1.06	BFGNGDGWDOFCPT-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	67115989

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.