8CI

4-(cyclopentylmethoxy)benzamide

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

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1 entries where 8CI is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	33
Chiral Atom Count	0
Bond Count	34
Aromatic Bond Count	6

2D diagram of 8CI

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Chemical Component Summary
Name	4-(cyclopentylmethoxy)benzamide
Systematic Name (OpenEye OEToolkits)	4-(cyclopentylmethoxy)benzamide
Formula	C₁₃ H₁₇ N O₂
Molecular Weight	219.28
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	NC(=O)c1ccc(OCC2CCCC2)cc1
SMILES	OpenEye OEToolkits	2.0.7	c1cc(ccc1C(=O)N)OCC2CCCC2
Canonical SMILES	CACTVS	3.385	NC(=O)c1ccc(OCC2CCCC2)cc1
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1cc(ccc1C(=O)N)OCC2CCCC2
InChI	InChI	1.06	InChI=1S/C13H17NO2/c14-13(15)11-5-7-12(8-6-11)16-9-10-3-1-2-4-10/h5-8,10H,1-4,9H2,(H2,14,15)
InChIKey	InChI	1.06	ONNDELCPTPJKGL-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	163203931

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.