I8M

2-[(morpholin-4-yl)methyl]phenol

Created:	2022-01-21
Last modified:	2022-02-09

Find Related PDB Entry
2 entries where I8M is found as a standalone ligand

Find related ligands:

Similar Ligands (Stereospecific) Similar Ligands (including Stereoisomers) Similar Ligands (Quick Screen) Similar Ligands (Substructure Stereospecific) Similar Ligands (Substructure including Stereoisomers)

Chemical Details
Formal Charge	0
Atom Count	29
Chiral Atom Count	0
Bond Count	30
Aromatic Bond Count	6

2D diagram of I8M

Toggle Hydrogen Toggle Labels

Chemical Component Summary
Name	2-[(morpholin-4-yl)methyl]phenol
Systematic Name (OpenEye OEToolkits)	2-(morpholin-4-ylmethyl)phenol
Formula	C₁₁ H₁₅ N O₂
Molecular Weight	193.242
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	Oc1ccccc1CN1CCOCC1
SMILES	CACTVS	3.385	Oc1ccccc1CN2CCOCC2
SMILES	OpenEye OEToolkits	2.0.7	c1ccc(c(c1)CN2CCOCC2)O
Canonical SMILES	CACTVS	3.385	Oc1ccccc1CN2CCOCC2
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1ccc(c(c1)CN2CCOCC2)O
InChI	InChI	1.03	InChI=1S/C11H15NO2/c13-11-4-2-1-3-10(11)9-12-5-7-14-8-6-12/h1-4,13H,5-9H2
InChIKey	InChI	1.03	OYLIEVIKIUHKTG-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	225458

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.