4-[2-(4-chlorophenyl)ethyl]morpholine

C12H16ClNO — CID 100965303

IUPAC4-[2-(4-chlorophenyl)ethyl]morpholine
SMILESClc1ccc(CCN2CCOCC2)cc1
InChIInChI=1S/C12H16ClNO/c13-12-3-1-11(2-4-12)5-6-14-7-9-15-10-8-14/h1-4H,5-10H2
InChIKeyQKWJEUCWLNIPAK-UHFFFAOYSA-N
MW225.72 g/mol
LogP2.21
Rot. Bonds3

About 4-[2-(4-chlorophenyl)ethyl]morpholine

4-[2-(4-chlorophenyl)ethyl]morpholine (PubChem CID 100965303) has the molecular formula C12H16ClNO and a molecular weight of 225.72 g/mol. Its IUPAC name is 4-[2-(4-chlorophenyl)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(4-chlorophenyl)ethyl]morpholine
PubChem CID100965303
Molecular FormulaC12H16ClNO
Molecular Weight225.72 g/mol
Exact Mass225.09
IUPAC Name4-[2-(4-chlorophenyl)ethyl]morpholine
SMILESClc1ccc(CCN2CCOCC2)cc1
InChIInChI=1S/C12H16ClNO/c13-12-3-1-11(2-4-12)5-6-14-7-9-15-10-8-14/h1-4H,5-10H2
InChIKeyQKWJEUCWLNIPAK-UHFFFAOYSA-N
XLogP2.21
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.72
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Pitolisant
CID 9948102
Pitolisant Hydrochloride
CID 11551689
ML398
CID 72737723
4-(3-Phenylpropyl)morpholine
CID 782728
2-(4-Chlorophenyl)-1-(4-morpholinyl)ethanethione
CID 229985
(4-Chlorophenyl)(morpholino)methanethione
CID 684261
2-(4-Chlorophenyl)-1-(4-morpholinyl)ethanone
CID 1124089
4-[(4-Chlorophenyl)methyl]morpholine
CID 783204
4-(2-Phenylethyl)morpholine
CID 411956
4-[3-(4-Chlorophenyl)-4-methylpentyl]morpholine
CID 17583223
4-(2-Chlorobenzyl)-2,6-dimethylmorpholine
CID 2843397
4-((1-(3,4-Dichlorophenyl)cyclohexyl)methyl)morpholine
CID 53323762

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-chlorophenyl)ethyl]morpholine?
The IUPAC name of 4-[2-(4-chlorophenyl)ethyl]morpholine (CID 100965303) is 4-[2-(4-chlorophenyl)ethyl]morpholine.
What is the SMILES notation for 4-[2-(4-chlorophenyl)ethyl]morpholine?
The canonical SMILES for 4-[2-(4-chlorophenyl)ethyl]morpholine is Clc1ccc(CCN2CCOCC2)cc1.
What is the InChIKey of 4-[2-(4-chlorophenyl)ethyl]morpholine?
The InChIKey is QKWJEUCWLNIPAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClNO/c13-12-3-1-11(2-4-12)5-6-14-7-9-15-10-8-14/h1-4H,5-10H2.
What are the key properties of 4-[2-(4-chlorophenyl)ethyl]morpholine?
4-[2-(4-chlorophenyl)ethyl]morpholine has a molecular weight of 225.72 g/mol, XLogP of 2.21, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-chlorophenyl)ethyl]morpholine is sourced from PubChem (CID 100965303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).