4-(2-phenylpropyl)morpholine

C13H19NO — CID 2845855

IUPAC4-(2-phenylpropyl)morpholine
SMILESCC(CN1CCOCC1)c1ccccc1
InChIInChI=1S/C13H19NO/c1-12(13-5-3-2-4-6-13)11-14-7-9-15-10-8-14/h2-6,12H,7-11H2,1H3
InChIKeyWRENTAXEJRYOTE-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.12
Rot. Bonds3

About 4-(2-phenylpropyl)morpholine

4-(2-phenylpropyl)morpholine (PubChem CID 2845855) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 4-(2-phenylpropyl)morpholine.

Molecular Properties

Compound Name4-(2-phenylpropyl)morpholine
PubChem CID2845855
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name4-(2-phenylpropyl)morpholine
SMILESCC(CN1CCOCC1)c1ccccc1
InChIInChI=1S/C13H19NO/c1-12(13-5-3-2-4-6-13)11-14-7-9-15-10-8-14/h2-6,12H,7-11H2,1H3
InChIKeyWRENTAXEJRYOTE-UHFFFAOYSA-N
XLogP2.12
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-phenylpropyl)morpholine?
The IUPAC name of 4-(2-phenylpropyl)morpholine (CID 2845855) is 4-(2-phenylpropyl)morpholine.
What is the SMILES notation for 4-(2-phenylpropyl)morpholine?
The canonical SMILES for 4-(2-phenylpropyl)morpholine is CC(CN1CCOCC1)c1ccccc1.
What is the InChIKey of 4-(2-phenylpropyl)morpholine?
The InChIKey is WRENTAXEJRYOTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-12(13-5-3-2-4-6-13)11-14-7-9-15-10-8-14/h2-6,12H,7-11H2,1H3.
What are the key properties of 4-(2-phenylpropyl)morpholine?
4-(2-phenylpropyl)morpholine has a molecular weight of 205.30 g/mol, XLogP of 2.12, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-phenylpropyl)morpholine is sourced from PubChem (CID 2845855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).