4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine

C16H18ClNO2 — CID 868523

IUPAC4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine
SMILESClc1ccc(OCCN2CCOCC2)c2ccccc12
InChIInChI=1S/C16H18ClNO2/c17-15-5-6-16(14-4-2-1-3-13(14)15)20-12-9-18-7-10-19-11-8-18/h1-6H,7-12H2
InChIKeyQXCZZVTWQPSOTB-UHFFFAOYSA-N
MW291.78 g/mol
LogP3.20
Rot. Bonds4

About 4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine

4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine (PubChem CID 868523) has the molecular formula C16H18ClNO2 and a molecular weight of 291.78 g/mol. Its IUPAC name is 4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine.

Molecular Properties

Compound Name4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine
PubChem CID868523
Molecular FormulaC16H18ClNO2
Molecular Weight291.78 g/mol
Exact Mass291.10
IUPAC Name4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine
SMILESClc1ccc(OCCN2CCOCC2)c2ccccc12
InChIInChI=1S/C16H18ClNO2/c17-15-5-6-16(14-4-2-1-3-13(14)15)20-12-9-18-7-10-19-11-8-18/h1-6H,7-12H2
InChIKeyQXCZZVTWQPSOTB-UHFFFAOYSA-N
XLogP3.20
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.78
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(2-morpholin-4-ylethoxy)naphthalen-1-yl] cyanate
CID 143015562
4-[2-(4-nitronaphthalen-1-yl)oxyethyl]morpholine
CID 11991204
1-[2-[2-(4-chloronaphthalen-1-yl)oxyethoxy]ethyl]-4-methylpiperazine
CID 30088160
4-[2-(2,3-dichlorophenoxy)ethyl]morpholine
CID 869488
3-[4-[2-(4-chloronaphthalen-1-yl)oxyethyl]piperazin-1-yl]oxolan-2-one
CID 171914103
[4-(2-morpholin-4-ylethoxy)naphthalen-1-yl]urea
CID 18628987
1-[4-(2-morpholin-4-ylethoxy)naphthalen-1-yl]propane-1,2-dione
CID 58262575
4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine
CID 122524434
2,2-difluoro-2-[4-(2-morpholin-4-ylethoxy)naphthalen-1-yl]acetic acid
CID 59379811
4-[2-[2-(chloromethyl)phenoxy]ethyl]morpholine
CID 18179953
N,N-dichloro-2-(2-morpholin-4-ylethoxy)aniline
CID 142799192
1-tert-butyl-2-[4-(2-morpholin-4-ylethoxy)naphthalen-1-yl]-1,2,4-triazolidine-3,5-dione
CID 11464077

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine?
The IUPAC name of 4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine (CID 868523) is 4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine.
What is the SMILES notation for 4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine?
The canonical SMILES for 4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine is Clc1ccc(OCCN2CCOCC2)c2ccccc12.
What is the InChIKey of 4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine?
The InChIKey is QXCZZVTWQPSOTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClNO2/c17-15-5-6-16(14-4-2-1-3-13(14)15)20-12-9-18-7-10-19-11-8-18/h1-6H,7-12H2.
What are the key properties of 4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine?
4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine has a molecular weight of 291.78 g/mol, XLogP of 3.20, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine is sourced from PubChem (CID 868523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).