4-[phenyl(pyridin-3-yl)methyl]morpholine

C16H18N2O — CID 132574107

IUPAC4-[phenyl(pyridin-3-yl)methyl]morpholine
SMILESc1ccc(C(c2cccnc2)N2CCOCC2)cc1
InChIInChI=1S/C16H18N2O/c1-2-5-14(6-3-1)16(15-7-4-8-17-13-15)18-9-11-19-12-10-18/h1-8,13,16H,9-12H2
InChIKeyBOUDFFZFEYJQQN-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.50
Rot. Bonds3

About 4-[phenyl(pyridin-3-yl)methyl]morpholine

4-[phenyl(pyridin-3-yl)methyl]morpholine (PubChem CID 132574107) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 4-[phenyl(pyridin-3-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[phenyl(pyridin-3-yl)methyl]morpholine
PubChem CID132574107
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name4-[phenyl(pyridin-3-yl)methyl]morpholine
SMILESc1ccc(C(c2cccnc2)N2CCOCC2)cc1
InChIInChI=1S/C16H18N2O/c1-2-5-14(6-3-1)16(15-7-4-8-17-13-15)18-9-11-19-12-10-18/h1-8,13,16H,9-12H2
InChIKeyBOUDFFZFEYJQQN-UHFFFAOYSA-N
XLogP2.50
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[phenyl(pyridin-3-yl)methyl]morpholine?
The IUPAC name of 4-[phenyl(pyridin-3-yl)methyl]morpholine (CID 132574107) is 4-[phenyl(pyridin-3-yl)methyl]morpholine.
What is the SMILES notation for 4-[phenyl(pyridin-3-yl)methyl]morpholine?
The canonical SMILES for 4-[phenyl(pyridin-3-yl)methyl]morpholine is c1ccc(C(c2cccnc2)N2CCOCC2)cc1.
What is the InChIKey of 4-[phenyl(pyridin-3-yl)methyl]morpholine?
The InChIKey is BOUDFFZFEYJQQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-2-5-14(6-3-1)16(15-7-4-8-17-13-15)18-9-11-19-12-10-18/h1-8,13,16H,9-12H2.
What are the key properties of 4-[phenyl(pyridin-3-yl)methyl]morpholine?
4-[phenyl(pyridin-3-yl)methyl]morpholine has a molecular weight of 254.33 g/mol, XLogP of 2.50, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[phenyl(pyridin-3-yl)methyl]morpholine is sourced from PubChem (CID 132574107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).