4-[5-(4-chlorophenoxy)pentyl]morpholine

C15H22ClNO2 — CID 2057881

IUPAC4-[5-(4-chlorophenoxy)pentyl]morpholine
SMILESClc1ccc(OCCCCCN2CCOCC2)cc1
InChIInChI=1S/C15H22ClNO2/c16-14-4-6-15(7-5-14)19-11-3-1-2-8-17-9-12-18-13-10-17/h4-7H,1-3,8-13H2
InChIKeyBOLQYFVHOYCAMQ-UHFFFAOYSA-N
MW283.80 g/mol
LogP3.22
Rot. Bonds7

About 4-[5-(4-chlorophenoxy)pentyl]morpholine

4-[5-(4-chlorophenoxy)pentyl]morpholine (PubChem CID 2057881) has the molecular formula C15H22ClNO2 and a molecular weight of 283.80 g/mol. Its IUPAC name is 4-[5-(4-chlorophenoxy)pentyl]morpholine.

Molecular Properties

Compound Name4-[5-(4-chlorophenoxy)pentyl]morpholine
PubChem CID2057881
Molecular FormulaC15H22ClNO2
Molecular Weight283.80 g/mol
Exact Mass283.13
IUPAC Name4-[5-(4-chlorophenoxy)pentyl]morpholine
SMILESClc1ccc(OCCCCCN2CCOCC2)cc1
InChIInChI=1S/C15H22ClNO2/c16-14-4-6-15(7-5-14)19-11-3-1-2-8-17-9-12-18-13-10-17/h4-7H,1-3,8-13H2
InChIKeyBOLQYFVHOYCAMQ-UHFFFAOYSA-N
XLogP3.22
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.80
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[5-(4-chlorophenoxy)pentyl]morpholine?
The IUPAC name of 4-[5-(4-chlorophenoxy)pentyl]morpholine (CID 2057881) is 4-[5-(4-chlorophenoxy)pentyl]morpholine.
What is the SMILES notation for 4-[5-(4-chlorophenoxy)pentyl]morpholine?
The canonical SMILES for 4-[5-(4-chlorophenoxy)pentyl]morpholine is Clc1ccc(OCCCCCN2CCOCC2)cc1.
What is the InChIKey of 4-[5-(4-chlorophenoxy)pentyl]morpholine?
The InChIKey is BOLQYFVHOYCAMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO2/c16-14-4-6-15(7-5-14)19-11-3-1-2-8-17-9-12-18-13-10-17/h4-7H,1-3,8-13H2.
What are the key properties of 4-[5-(4-chlorophenoxy)pentyl]morpholine?
4-[5-(4-chlorophenoxy)pentyl]morpholine has a molecular weight of 283.80 g/mol, XLogP of 3.22, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(4-chlorophenoxy)pentyl]morpholine is sourced from PubChem (CID 2057881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).