4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine

C17H22N2O — CID 152540539

IUPAC4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine
SMILESC1=CN(CCc2ccccc2)CC=C1N1CCOCC1
InChIInChI=1S/C17H22N2O/c1-2-4-16(5-3-1)6-9-18-10-7-17(8-11-18)19-12-14-20-15-13-19/h1-5,7-8,10H,6,9,11-15H2
InChIKeyYLLIJSNQEWHIMT-UHFFFAOYSA-N
MW270.38 g/mol
LogP2.27
Rot. Bonds4

About 4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine

4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine (PubChem CID 152540539) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine.

Molecular Properties

Compound Name4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine
PubChem CID152540539
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine
SMILESC1=CN(CCc2ccccc2)CC=C1N1CCOCC1
InChIInChI=1S/C17H22N2O/c1-2-4-16(5-3-1)6-9-18-10-7-17(8-11-18)19-12-14-20-15-13-19/h1-5,7-8,10H,6,9,11-15H2
InChIKeyYLLIJSNQEWHIMT-UHFFFAOYSA-N
XLogP2.27
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine?
The IUPAC name of 4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine (CID 152540539) is 4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine.
What is the SMILES notation for 4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine?
The canonical SMILES for 4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine is C1=CN(CCc2ccccc2)CC=C1N1CCOCC1.
What is the InChIKey of 4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine?
The InChIKey is YLLIJSNQEWHIMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-2-4-16(5-3-1)6-9-18-10-7-17(8-11-18)19-12-14-20-15-13-19/h1-5,7-8,10H,6,9,11-15H2.
What are the key properties of 4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine?
4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine has a molecular weight of 270.38 g/mol, XLogP of 2.27, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine is sourced from PubChem (CID 152540539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).