4-[(2-fluoro-3,4-dihydronaphthalen-1-yl)methyl]morpholine

C15H18FNO — CID 102170790

IUPAC4-[(2-fluoro-3,4-dihydronaphthalen-1-yl)methyl]morpholine
SMILESFC1=C(CN2CCOCC2)c2ccccc2CC1
InChIInChI=1S/C15H18FNO/c16-15-6-5-12-3-1-2-4-13(12)14(15)11-17-7-9-18-10-8-17/h1-4H,5-11H2
InChIKeyZBWZFTMMYMSADE-UHFFFAOYSA-N
MW247.31 g/mol
LogP2.65
Rot. Bonds2

About 4-[(2-fluoro-3,4-dihydronaphthalen-1-yl)methyl]morpholine

4-[(2-fluoro-3,4-dihydronaphthalen-1-yl)methyl]morpholine (PubChem CID 102170790) has the molecular formula C15H18FNO and a molecular weight of 247.31 g/mol. Its IUPAC name is 4-[(2-fluoro-3,4-dihydronaphthalen-1-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[(2-fluoro-3,4-dihydronaphthalen-1-yl)methyl]morpholine
PubChem CID102170790
Molecular FormulaC15H18FNO
Molecular Weight247.31 g/mol
Exact Mass247.14
IUPAC Name4-[(2-fluoro-3,4-dihydronaphthalen-1-yl)methyl]morpholine
SMILESFC1=C(CN2CCOCC2)c2ccccc2CC1
InChIInChI=1S/C15H18FNO/c16-15-6-5-12-3-1-2-4-13(12)14(15)11-17-7-9-18-10-8-17/h1-4H,5-11H2
InChIKeyZBWZFTMMYMSADE-UHFFFAOYSA-N
XLogP2.65
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.31
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-fluoro-3,4-dihydronaphthalen-1-yl)methyl]morpholine?
The IUPAC name of 4-[(2-fluoro-3,4-dihydronaphthalen-1-yl)methyl]morpholine (CID 102170790) is 4-[(2-fluoro-3,4-dihydronaphthalen-1-yl)methyl]morpholine.
What is the SMILES notation for 4-[(2-fluoro-3,4-dihydronaphthalen-1-yl)methyl]morpholine?
The canonical SMILES for 4-[(2-fluoro-3,4-dihydronaphthalen-1-yl)methyl]morpholine is FC1=C(CN2CCOCC2)c2ccccc2CC1.
What is the InChIKey of 4-[(2-fluoro-3,4-dihydronaphthalen-1-yl)methyl]morpholine?
The InChIKey is ZBWZFTMMYMSADE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FNO/c16-15-6-5-12-3-1-2-4-13(12)14(15)11-17-7-9-18-10-8-17/h1-4H,5-11H2.
What are the key properties of 4-[(2-fluoro-3,4-dihydronaphthalen-1-yl)methyl]morpholine?
4-[(2-fluoro-3,4-dihydronaphthalen-1-yl)methyl]morpholine has a molecular weight of 247.31 g/mol, XLogP of 2.65, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-fluoro-3,4-dihydronaphthalen-1-yl)methyl]morpholine is sourced from PubChem (CID 102170790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).