2-[[2-(2-chlorophenoxy)phenyl]methyl]-4-methylmorpholine

C18H20ClNO2 — CID 150616365

IUPAC2-[[2-(2-chlorophenoxy)phenyl]methyl]-4-methylmorpholine
SMILESCN1CCOC(Cc2ccccc2Oc2ccccc2Cl)C1
InChIInChI=1S/C18H20ClNO2/c1-20-10-11-21-15(13-20)12-14-6-2-4-8-17(14)22-18-9-5-3-7-16(18)19/h2-9,15H,10-13H2,1H3
InChIKeyIUYYFLIJWRSZQY-UHFFFAOYSA-N
MW317.82 g/mol
LogP4.01
Rot. Bonds4

About 2-[[2-(2-chlorophenoxy)phenyl]methyl]-4-methylmorpholine

2-[[2-(2-chlorophenoxy)phenyl]methyl]-4-methylmorpholine (PubChem CID 150616365) has the molecular formula C18H20ClNO2 and a molecular weight of 317.82 g/mol. Its IUPAC name is 2-[[2-(2-chlorophenoxy)phenyl]methyl]-4-methylmorpholine.

Molecular Properties

Compound Name2-[[2-(2-chlorophenoxy)phenyl]methyl]-4-methylmorpholine
PubChem CID150616365
Molecular FormulaC18H20ClNO2
Molecular Weight317.82 g/mol
Exact Mass317.12
IUPAC Name2-[[2-(2-chlorophenoxy)phenyl]methyl]-4-methylmorpholine
SMILESCN1CCOC(Cc2ccccc2Oc2ccccc2Cl)C1
InChIInChI=1S/C18H20ClNO2/c1-20-10-11-21-15(13-20)12-14-6-2-4-8-17(14)22-18-9-5-3-7-16(18)19/h2-9,15H,10-13H2,1H3
InChIKeyIUYYFLIJWRSZQY-UHFFFAOYSA-N
XLogP4.01
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.82
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(2-chlorophenoxy)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propanamide
CID 94815626
N-[[4-(2-chlorophenoxy)-3-nitrophenyl]methyl]-1-(4-methylmorpholin-2-yl)methanamine
CID 119123103
[2-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine
CID 79166937
2-[(2-chloro-5-fluorophenoxy)methyl]-4-methylmorpholine
CID 114264381
2-(2-chlorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]acetamide
CID 49093905
[3-chloro-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine
CID 112607579
[3-chloro-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanol
CID 112612743
2-[(2S)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]ethanol
CID 125000372
N-[[2-[(4-methylmorpholin-2-yl)methoxy]phenyl]methyl]cyclopropanamine
CID 79171206
2-[[2-(2-cyclohexylethyl)phenoxy]methyl]-4-methylmorpholine;hydrochloride
CID 139662067
N-[(2-ethoxyphenyl)methyl]-1-(4-methylmorpholin-2-yl)methanamine
CID 78943123
(2S)-2-[(2-chlorophenyl)methyl]-4-[(1-methylimidazol-2-yl)methyl]morpholine
CID 42511055

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-chlorophenoxy)phenyl]methyl]-4-methylmorpholine?
The IUPAC name of 2-[[2-(2-chlorophenoxy)phenyl]methyl]-4-methylmorpholine (CID 150616365) is 2-[[2-(2-chlorophenoxy)phenyl]methyl]-4-methylmorpholine.
What is the SMILES notation for 2-[[2-(2-chlorophenoxy)phenyl]methyl]-4-methylmorpholine?
The canonical SMILES for 2-[[2-(2-chlorophenoxy)phenyl]methyl]-4-methylmorpholine is CN1CCOC(Cc2ccccc2Oc2ccccc2Cl)C1.
What is the InChIKey of 2-[[2-(2-chlorophenoxy)phenyl]methyl]-4-methylmorpholine?
The InChIKey is IUYYFLIJWRSZQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO2/c1-20-10-11-21-15(13-20)12-14-6-2-4-8-17(14)22-18-9-5-3-7-16(18)19/h2-9,15H,10-13H2,1H3.
What are the key properties of 2-[[2-(2-chlorophenoxy)phenyl]methyl]-4-methylmorpholine?
2-[[2-(2-chlorophenoxy)phenyl]methyl]-4-methylmorpholine has a molecular weight of 317.82 g/mol, XLogP of 4.01, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-chlorophenoxy)phenyl]methyl]-4-methylmorpholine is sourced from PubChem (CID 150616365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).