2-[5-(4-methylphenyl)-2-pyridinyl]morpholine

C16H18N2O — CID 110271384

IUPAC2-[5-(4-methylphenyl)-2-pyridinyl]morpholine
SMILESCc1ccc(-c2ccc(C3CNCCO3)nc2)cc1
InChIInChI=1S/C16H18N2O/c1-12-2-4-13(5-3-12)14-6-7-15(18-10-14)16-11-17-8-9-19-16/h2-7,10,16-17H,8-9,11H2,1H3
InChIKeyYAKVTWXUGUCHNJ-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.72
Rot. Bonds2

About 2-[5-(4-methylphenyl)-2-pyridinyl]morpholine

2-[5-(4-methylphenyl)-2-pyridinyl]morpholine (PubChem CID 110271384) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-[5-(4-methylphenyl)-2-pyridinyl]morpholine.

Molecular Properties

Compound Name2-[5-(4-methylphenyl)-2-pyridinyl]morpholine
PubChem CID110271384
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name2-[5-(4-methylphenyl)-2-pyridinyl]morpholine
SMILESCc1ccc(-c2ccc(C3CNCCO3)nc2)cc1
InChIInChI=1S/C16H18N2O/c1-12-2-4-13(5-3-12)14-6-7-15(18-10-14)16-11-17-8-9-19-16/h2-7,10,16-17H,8-9,11H2,1H3
InChIKeyYAKVTWXUGUCHNJ-UHFFFAOYSA-N
XLogP2.72
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(4-methylphenyl)-2-pyridinyl]morpholine?
The IUPAC name of 2-[5-(4-methylphenyl)-2-pyridinyl]morpholine (CID 110271384) is 2-[5-(4-methylphenyl)-2-pyridinyl]morpholine.
What is the SMILES notation for 2-[5-(4-methylphenyl)-2-pyridinyl]morpholine?
The canonical SMILES for 2-[5-(4-methylphenyl)-2-pyridinyl]morpholine is Cc1ccc(-c2ccc(C3CNCCO3)nc2)cc1.
What is the InChIKey of 2-[5-(4-methylphenyl)-2-pyridinyl]morpholine?
The InChIKey is YAKVTWXUGUCHNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-12-2-4-13(5-3-12)14-6-7-15(18-10-14)16-11-17-8-9-19-16/h2-7,10,16-17H,8-9,11H2,1H3.
What are the key properties of 2-[5-(4-methylphenyl)-2-pyridinyl]morpholine?
2-[5-(4-methylphenyl)-2-pyridinyl]morpholine has a molecular weight of 254.33 g/mol, XLogP of 2.72, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(4-methylphenyl)-2-pyridinyl]morpholine is sourced from PubChem (CID 110271384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).