2-(3-methoxyphenyl)-4-propylmorpholine

C14H21NO2 — CID 15006482

IUPAC2-(3-methoxyphenyl)-4-propylmorpholine
SMILESCCCN1CCOC(c2cccc(OC)c2)C1
InChIInChI=1S/C14H21NO2/c1-3-7-15-8-9-17-14(11-15)12-5-4-6-13(10-12)16-2/h4-6,10,14H,3,7-9,11H2,1-2H3
InChIKeyBLVMMLMFXYKMPX-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.48
Rot. Bonds4

About 2-(3-methoxyphenyl)-4-propylmorpholine

2-(3-methoxyphenyl)-4-propylmorpholine (PubChem CID 15006482) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-4-propylmorpholine.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-4-propylmorpholine
PubChem CID15006482
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-(3-methoxyphenyl)-4-propylmorpholine
SMILESCCCN1CCOC(c2cccc(OC)c2)C1
InChIInChI=1S/C14H21NO2/c1-3-7-15-8-9-17-14(11-15)12-5-4-6-13(10-12)16-2/h4-6,10,14H,3,7-9,11H2,1-2H3
InChIKeyBLVMMLMFXYKMPX-UHFFFAOYSA-N
XLogP2.48
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-4-propylmorpholine?
The IUPAC name of 2-(3-methoxyphenyl)-4-propylmorpholine (CID 15006482) is 2-(3-methoxyphenyl)-4-propylmorpholine.
What is the SMILES notation for 2-(3-methoxyphenyl)-4-propylmorpholine?
The canonical SMILES for 2-(3-methoxyphenyl)-4-propylmorpholine is CCCN1CCOC(c2cccc(OC)c2)C1.
What is the InChIKey of 2-(3-methoxyphenyl)-4-propylmorpholine?
The InChIKey is BLVMMLMFXYKMPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-3-7-15-8-9-17-14(11-15)12-5-4-6-13(10-12)16-2/h4-6,10,14H,3,7-9,11H2,1-2H3.
What are the key properties of 2-(3-methoxyphenyl)-4-propylmorpholine?
2-(3-methoxyphenyl)-4-propylmorpholine has a molecular weight of 235.33 g/mol, XLogP of 2.48, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-4-propylmorpholine is sourced from PubChem (CID 15006482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).