L7F

2-[(1S,5R)-bicyclo[3.1.0]hexan-1-yl]-N-(4-methylpyridin-3-yl)acetamide

Created:	2023-08-15
Last modified:	2023-11-08

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1 entries where L7F is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	35
Chiral Atom Count	2
Bond Count	37
Aromatic Bond Count	6

2D diagram of L7F

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Chemical Component Summary
Name	2-[(1S,5R)-bicyclo[3.1.0]hexan-1-yl]-N-(4-methylpyridin-3-yl)acetamide
Systematic Name (OpenEye OEToolkits)	2-[(1~{S},5~{R})-1-bicyclo[3.1.0]hexanyl]-~{N}-(4-methylpyridin-3-yl)ethanamide
Formula	C₁₄ H₁₈ N₂ O
Molecular Weight	230.306
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(Nc1cnccc1C)CC12CC2CCC1
SMILES	CACTVS	3.385	Cc1ccncc1NC(=O)C[C]23CCC[CH]2C3
SMILES	OpenEye OEToolkits	2.0.7	Cc1ccncc1NC(=O)CC23CCCC2C3
Canonical SMILES	CACTVS	3.385	Cc1ccncc1NC(=O)C[C@@]23CCC[C@@H]2C3
Canonical SMILES	OpenEye OEToolkits	2.0.7	Cc1ccncc1NC(=O)C[C@@]23CCC[C@@H]2C3
InChI	InChI	1.06	InChI=1S/C14H18N2O/c1-10-4-6-15-9-12(10)16-13(17)8-14-5-2-3-11(14)7-14/h4,6,9,11H,2-3,5,7-8H2,1H3,(H,16,17)/t11-,14+/m1/s1
InChIKey	InChI	1.06	ZVPGUVBZPWGJPX-RISCZKNCSA-N

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.