4-[5-(3-methylphenoxy)pentyl]morpholine

C16H25NO2 — CID 2202905

IUPAC4-[5-(3-methylphenoxy)pentyl]morpholine
SMILESCc1cccc(OCCCCCN2CCOCC2)c1
InChIInChI=1S/C16H25NO2/c1-15-6-5-7-16(14-15)19-11-4-2-3-8-17-9-12-18-13-10-17/h5-7,14H,2-4,8-13H2,1H3
InChIKeyFUGRMCXXHCFXEH-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.88
Rot. Bonds7

About 4-[5-(3-methylphenoxy)pentyl]morpholine

4-[5-(3-methylphenoxy)pentyl]morpholine (PubChem CID 2202905) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 4-[5-(3-methylphenoxy)pentyl]morpholine.

Molecular Properties

Compound Name4-[5-(3-methylphenoxy)pentyl]morpholine
PubChem CID2202905
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name4-[5-(3-methylphenoxy)pentyl]morpholine
SMILESCc1cccc(OCCCCCN2CCOCC2)c1
InChIInChI=1S/C16H25NO2/c1-15-6-5-7-16(14-15)19-11-4-2-3-8-17-9-12-18-13-10-17/h5-7,14H,2-4,8-13H2,1H3
InChIKeyFUGRMCXXHCFXEH-UHFFFAOYSA-N
XLogP2.88
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.88
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-(3-methylphenoxy)pentyl]morpholine?
The IUPAC name of 4-[5-(3-methylphenoxy)pentyl]morpholine (CID 2202905) is 4-[5-(3-methylphenoxy)pentyl]morpholine.
What is the SMILES notation for 4-[5-(3-methylphenoxy)pentyl]morpholine?
The canonical SMILES for 4-[5-(3-methylphenoxy)pentyl]morpholine is Cc1cccc(OCCCCCN2CCOCC2)c1.
What is the InChIKey of 4-[5-(3-methylphenoxy)pentyl]morpholine?
The InChIKey is FUGRMCXXHCFXEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-15-6-5-7-16(14-15)19-11-4-2-3-8-17-9-12-18-13-10-17/h5-7,14H,2-4,8-13H2,1H3.
What are the key properties of 4-[5-(3-methylphenoxy)pentyl]morpholine?
4-[5-(3-methylphenoxy)pentyl]morpholine has a molecular weight of 263.38 g/mol, XLogP of 2.88, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(3-methylphenoxy)pentyl]morpholine is sourced from PubChem (CID 2202905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).