4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine

C14H20ClNO2 — CID 872206

IUPAC4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine
SMILESCc1cc(Cl)cc(C)c1OCCN1CCOCC1
InChIInChI=1S/C14H20ClNO2/c1-11-9-13(15)10-12(2)14(11)18-8-5-16-3-6-17-7-4-16/h9-10H,3-8H2,1-2H3
InChIKeyMNFFVVYWRCGTFN-UHFFFAOYSA-N
MW269.77 g/mol
LogP2.67
Rot. Bonds4

About 4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine

4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine (PubChem CID 872206) has the molecular formula C14H20ClNO2 and a molecular weight of 269.77 g/mol. Its IUPAC name is 4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine
PubChem CID872206
Molecular FormulaC14H20ClNO2
Molecular Weight269.77 g/mol
Exact Mass269.12
IUPAC Name4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine
SMILESCc1cc(Cl)cc(C)c1OCCN1CCOCC1
InChIInChI=1S/C14H20ClNO2/c1-11-9-13(15)10-12(2)14(11)18-8-5-16-3-6-17-7-4-16/h9-10H,3-8H2,1-2H3
InChIKeyMNFFVVYWRCGTFN-UHFFFAOYSA-N
XLogP2.67
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.77
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(2-bromo-4-chloro-6-methylphenoxy)ethyl]morpholine
CID 2995112
4-[2-(2-chloro-4,6-dimethylphenoxy)ethyl]morpholine
CID 869403
4-[2-(2,6-dimethyl-4-propan-2-ylphenoxy)ethyl]morpholine
CID 20871910
1-[3-(4-chloro-2,6-dimethylphenoxy)propyl]piperazine
CID 2195012
1-[5-chloro-3-methoxy-2-(2-morpholin-4-ylethoxy)phenyl]-N-methylmethanamine
CID 104664509
5-chloro-2-[2-(4-chloro-2,6-dimethylphenoxy)ethoxy]-1,3-dimethylbenzene
CID 123242846
4-(2,4-dichloro-6-methylphenoxy)-N-(2-morpholin-4-ylethyl)butan-1-amine;oxalic acid
CID 2977574
4-[2-(4-methylnaphthalen-2-yl)oxyethyl]morpholine
CID 143504994
4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine
CID 868362
6,8-dichloro-2-(4-methylphenyl)-3-(2-morpholin-4-ylethoxy)chromen-4-one
CID 21001713
1-[3,5-dimethyl-4-(2-morpholin-4-ylethoxy)phenyl]-3,3-diphenylpropan-1-one;hydrochloride
CID 70604327
3,5-dimethyl-4-(2-pyrrolidin-1-ylethoxy)aniline
CID 18327476

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine?
The IUPAC name of 4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine (CID 872206) is 4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine.
What is the SMILES notation for 4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine?
The canonical SMILES for 4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine is Cc1cc(Cl)cc(C)c1OCCN1CCOCC1.
What is the InChIKey of 4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine?
The InChIKey is MNFFVVYWRCGTFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClNO2/c1-11-9-13(15)10-12(2)14(11)18-8-5-16-3-6-17-7-4-16/h9-10H,3-8H2,1-2H3.
What are the key properties of 4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine?
4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine has a molecular weight of 269.77 g/mol, XLogP of 2.67, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine is sourced from PubChem (CID 872206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).