4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine

C12H15ClINO2 — CID 122524434

IUPAC4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine
SMILESClc1ccc(I)cc1OCCN1CCOCC1
InChIInChI=1S/C12H15ClINO2/c13-11-2-1-10(14)9-12(11)17-8-5-15-3-6-16-7-4-15/h1-2,9H,3-8H2
InChIKeyBUILPJGZILZFOV-UHFFFAOYSA-N
MW367.61 g/mol
LogP2.66
Rot. Bonds4

About 4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine

4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine (PubChem CID 122524434) has the molecular formula C12H15ClINO2 and a molecular weight of 367.61 g/mol. Its IUPAC name is 4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine
PubChem CID122524434
Molecular FormulaC12H15ClINO2
Molecular Weight367.61 g/mol
Exact Mass366.98
IUPAC Name4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine
SMILESClc1ccc(I)cc1OCCN1CCOCC1
InChIInChI=1S/C12H15ClINO2/c13-11-2-1-10(14)9-12(11)17-8-5-15-3-6-16-7-4-15/h1-2,9H,3-8H2
InChIKeyBUILPJGZILZFOV-UHFFFAOYSA-N
XLogP2.66
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.61
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine
CID 868523
4-[2-(2,3-dichlorophenoxy)ethyl]morpholine
CID 869488
[4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine
CID 114322345
cesium;2,6-dichloro-3-(2-morpholin-4-ylethoxy)benzoic acid;hydride
CID 173253218
4-[2-[2-(chloromethyl)phenoxy]ethyl]morpholine
CID 18179953
3-chloro-4-(3-morpholin-4-ylpropoxy)aniline
CID 123911683
1-[[3-chloro-4-(2-morpholin-4-ylethoxy)phenyl]methyl]-4-methylpyrrolidin-3-amine
CID 120909283
methyl 2,6-dichloro-3-(2-morpholin-4-ylethoxy)benzoate;hydrochloride
CID 70084406
(1R)-1-[5-chloro-2-(2-morpholin-4-ylethoxy)phenyl]ethanamine
CID 55189907
N,N-dichloro-2-(2-morpholin-4-ylethoxy)aniline
CID 142799192
4-[3-(3-iodophenoxy)propyl]morpholine
CID 47520354
N-[[3,6-dichloro-2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-ylidene]amino]aniline
CID 4978442

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine?
The IUPAC name of 4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine (CID 122524434) is 4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine.
What is the SMILES notation for 4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine?
The canonical SMILES for 4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine is Clc1ccc(I)cc1OCCN1CCOCC1.
What is the InChIKey of 4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine?
The InChIKey is BUILPJGZILZFOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClINO2/c13-11-2-1-10(14)9-12(11)17-8-5-15-3-6-16-7-4-15/h1-2,9H,3-8H2.
What are the key properties of 4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine?
4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine has a molecular weight of 367.61 g/mol, XLogP of 2.66, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine is sourced from PubChem (CID 122524434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).