4-[(4-fluorophenyl)-pyridin-2-ylmethyl]morpholine

C16H17FN2O — CID 134954093

IUPAC4-[(4-fluorophenyl)-pyridin-2-ylmethyl]morpholine
SMILESFc1ccc(C(c2ccccn2)N2CCOCC2)cc1
InChIInChI=1S/C16H17FN2O/c17-14-6-4-13(5-7-14)16(15-3-1-2-8-18-15)19-9-11-20-12-10-19/h1-8,16H,9-12H2
InChIKeyRMCLQCLTIIBHDW-UHFFFAOYSA-N
MW272.32 g/mol
LogP2.64
Rot. Bonds3

About 4-[(4-fluorophenyl)-pyridin-2-ylmethyl]morpholine

4-[(4-fluorophenyl)-pyridin-2-ylmethyl]morpholine (PubChem CID 134954093) has the molecular formula C16H17FN2O and a molecular weight of 272.32 g/mol. Its IUPAC name is 4-[(4-fluorophenyl)-pyridin-2-ylmethyl]morpholine.

Molecular Properties

Compound Name4-[(4-fluorophenyl)-pyridin-2-ylmethyl]morpholine
PubChem CID134954093
Molecular FormulaC16H17FN2O
Molecular Weight272.32 g/mol
Exact Mass272.13
IUPAC Name4-[(4-fluorophenyl)-pyridin-2-ylmethyl]morpholine
SMILESFc1ccc(C(c2ccccn2)N2CCOCC2)cc1
InChIInChI=1S/C16H17FN2O/c17-14-6-4-13(5-7-14)16(15-3-1-2-8-18-15)19-9-11-20-12-10-19/h1-8,16H,9-12H2
InChIKeyRMCLQCLTIIBHDW-UHFFFAOYSA-N
XLogP2.64
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.32
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluorophenyl)-pyridin-2-ylmethyl]morpholine?
The IUPAC name of 4-[(4-fluorophenyl)-pyridin-2-ylmethyl]morpholine (CID 134954093) is 4-[(4-fluorophenyl)-pyridin-2-ylmethyl]morpholine.
What is the SMILES notation for 4-[(4-fluorophenyl)-pyridin-2-ylmethyl]morpholine?
The canonical SMILES for 4-[(4-fluorophenyl)-pyridin-2-ylmethyl]morpholine is Fc1ccc(C(c2ccccn2)N2CCOCC2)cc1.
What is the InChIKey of 4-[(4-fluorophenyl)-pyridin-2-ylmethyl]morpholine?
The InChIKey is RMCLQCLTIIBHDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O/c17-14-6-4-13(5-7-14)16(15-3-1-2-8-18-15)19-9-11-20-12-10-19/h1-8,16H,9-12H2.
What are the key properties of 4-[(4-fluorophenyl)-pyridin-2-ylmethyl]morpholine?
4-[(4-fluorophenyl)-pyridin-2-ylmethyl]morpholine has a molecular weight of 272.32 g/mol, XLogP of 2.64, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluorophenyl)-pyridin-2-ylmethyl]morpholine is sourced from PubChem (CID 134954093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).