2-(1-phenylpropyl)morpholine

C13H19NO — CID 70531832

IUPAC2-(1-phenylpropyl)morpholine
SMILESCCC(c1ccccc1)C1CNCCO1
InChIInChI=1S/C13H19NO/c1-2-12(11-6-4-3-5-7-11)13-10-14-8-9-15-13/h3-7,12-14H,2,8-10H2,1H3
InChIKeyKLEIRHDUXWPGND-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.17
Rot. Bonds3

About 2-(1-phenylpropyl)morpholine

2-(1-phenylpropyl)morpholine (PubChem CID 70531832) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-(1-phenylpropyl)morpholine.

Molecular Properties

Compound Name2-(1-phenylpropyl)morpholine
PubChem CID70531832
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2-(1-phenylpropyl)morpholine
SMILESCCC(c1ccccc1)C1CNCCO1
InChIInChI=1S/C13H19NO/c1-2-12(11-6-4-3-5-7-11)13-10-14-8-9-15-13/h3-7,12-14H,2,8-10H2,1H3
InChIKeyKLEIRHDUXWPGND-UHFFFAOYSA-N
XLogP2.17
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-phenylpropyl)morpholine?
The IUPAC name of 2-(1-phenylpropyl)morpholine (CID 70531832) is 2-(1-phenylpropyl)morpholine.
What is the SMILES notation for 2-(1-phenylpropyl)morpholine?
The canonical SMILES for 2-(1-phenylpropyl)morpholine is CCC(c1ccccc1)C1CNCCO1.
What is the InChIKey of 2-(1-phenylpropyl)morpholine?
The InChIKey is KLEIRHDUXWPGND-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-2-12(11-6-4-3-5-7-11)13-10-14-8-9-15-13/h3-7,12-14H,2,8-10H2,1H3.
What are the key properties of 2-(1-phenylpropyl)morpholine?
2-(1-phenylpropyl)morpholine has a molecular weight of 205.30 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-phenylpropyl)morpholine is sourced from PubChem (CID 70531832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).