4-[(2,5-difluorophenyl)methyl]morpholine

C11H13F2NO — CID 743078

IUPAC4-[(2,5-difluorophenyl)methyl]morpholine
SMILESFc1ccc(F)c(CN2CCOCC2)c1
InChIInChI=1S/C11H13F2NO/c12-10-1-2-11(13)9(7-10)8-14-3-5-15-6-4-14/h1-2,7H,3-6,8H2
InChIKeyUDGOQDUPOHWPAZ-UHFFFAOYSA-N
MW213.23 g/mol
LogP1.80
Rot. Bonds2

About 4-[(2,5-difluorophenyl)methyl]morpholine

4-[(2,5-difluorophenyl)methyl]morpholine (PubChem CID 743078) has the molecular formula C11H13F2NO and a molecular weight of 213.23 g/mol. Its IUPAC name is 4-[(2,5-difluorophenyl)methyl]morpholine.

Molecular Properties

Compound Name4-[(2,5-difluorophenyl)methyl]morpholine
PubChem CID743078
Molecular FormulaC11H13F2NO
Molecular Weight213.23 g/mol
Exact Mass213.10
IUPAC Name4-[(2,5-difluorophenyl)methyl]morpholine
SMILESFc1ccc(F)c(CN2CCOCC2)c1
InChIInChI=1S/C11H13F2NO/c12-10-1-2-11(13)9(7-10)8-14-3-5-15-6-4-14/h1-2,7H,3-6,8H2
InChIKeyUDGOQDUPOHWPAZ-UHFFFAOYSA-N
XLogP1.80
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.23
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

13-(Phenylmethyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane
CID 130398
Morpholino(phenyl)acetonitrile
CID 85812
4-(3-Phenylpropyl)morpholine
CID 782728
Thiobenzoylmorpholine
CID 16244
4-((Morpholin-4-yl)methyl)benzonitrile
CID 216864
3-Benzyloxazolidine
CID 319258
4-Benzylmorpholine
CID 249546
10-Benzyl-1,4,7-trioxa-10-azacyclododecane
CID 766194
Dimorpholinophenylmethane
CID 80899
1-(4-Fluorobenzyl)-4-(2-Hydroxyethyl)Piperazine
CID 693807
3-Morpholin-4-ylmethyl-benzylamine
CID 6484182
2-(4-Fluorophenyl)-2-(morpholin-4-yl)ethan-1-amine
CID 4352885

Frequently Asked Questions

What is the IUPAC name of 4-[(2,5-difluorophenyl)methyl]morpholine?
The IUPAC name of 4-[(2,5-difluorophenyl)methyl]morpholine (CID 743078) is 4-[(2,5-difluorophenyl)methyl]morpholine.
What is the SMILES notation for 4-[(2,5-difluorophenyl)methyl]morpholine?
The canonical SMILES for 4-[(2,5-difluorophenyl)methyl]morpholine is Fc1ccc(F)c(CN2CCOCC2)c1.
What is the InChIKey of 4-[(2,5-difluorophenyl)methyl]morpholine?
The InChIKey is UDGOQDUPOHWPAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F2NO/c12-10-1-2-11(13)9(7-10)8-14-3-5-15-6-4-14/h1-2,7H,3-6,8H2.
What are the key properties of 4-[(2,5-difluorophenyl)methyl]morpholine?
4-[(2,5-difluorophenyl)methyl]morpholine has a molecular weight of 213.23 g/mol, XLogP of 1.80, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,5-difluorophenyl)methyl]morpholine is sourced from PubChem (CID 743078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).