2-phenyl-4-(2-pyridin-4-ylethyl)morpholine

C17H20N2O — CID 56812062

IUPAC2-phenyl-4-(2-pyridin-4-ylethyl)morpholine
SMILESc1ccc(C2CN(CCc3ccncc3)CCO2)cc1
InChIInChI=1S/C17H20N2O/c1-2-4-16(5-3-1)17-14-19(12-13-20-17)11-8-15-6-9-18-10-7-15/h1-7,9-10,17H,8,11-14H2
InChIKeyLCQXLHHNVVSKDD-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.70
Rot. Bonds4

About 2-phenyl-4-(2-pyridin-4-ylethyl)morpholine

2-phenyl-4-(2-pyridin-4-ylethyl)morpholine (PubChem CID 56812062) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-phenyl-4-(2-pyridin-4-ylethyl)morpholine.

Molecular Properties

Compound Name2-phenyl-4-(2-pyridin-4-ylethyl)morpholine
PubChem CID56812062
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name2-phenyl-4-(2-pyridin-4-ylethyl)morpholine
SMILESc1ccc(C2CN(CCc3ccncc3)CCO2)cc1
InChIInChI=1S/C17H20N2O/c1-2-4-16(5-3-1)17-14-19(12-13-20-17)11-8-15-6-9-18-10-7-15/h1-7,9-10,17H,8,11-14H2
InChIKeyLCQXLHHNVVSKDD-UHFFFAOYSA-N
XLogP2.70
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-(2-pyridin-4-ylethyl)morpholine?
The IUPAC name of 2-phenyl-4-(2-pyridin-4-ylethyl)morpholine (CID 56812062) is 2-phenyl-4-(2-pyridin-4-ylethyl)morpholine.
What is the SMILES notation for 2-phenyl-4-(2-pyridin-4-ylethyl)morpholine?
The canonical SMILES for 2-phenyl-4-(2-pyridin-4-ylethyl)morpholine is c1ccc(C2CN(CCc3ccncc3)CCO2)cc1.
What is the InChIKey of 2-phenyl-4-(2-pyridin-4-ylethyl)morpholine?
The InChIKey is LCQXLHHNVVSKDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-2-4-16(5-3-1)17-14-19(12-13-20-17)11-8-15-6-9-18-10-7-15/h1-7,9-10,17H,8,11-14H2.
What are the key properties of 2-phenyl-4-(2-pyridin-4-ylethyl)morpholine?
2-phenyl-4-(2-pyridin-4-ylethyl)morpholine has a molecular weight of 268.36 g/mol, XLogP of 2.70, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-(2-pyridin-4-ylethyl)morpholine is sourced from PubChem (CID 56812062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).