4-[2-(3,3-difluoropiperidin-1-yl)ethyl]morpholine

C11H20F2N2O — CID 117007662

IUPAC4-[2-(3,3-difluoropiperidin-1-yl)ethyl]morpholine
SMILESFC1(F)CCCN(CCN2CCOCC2)C1
InChIInChI=1S/C11H20F2N2O/c12-11(13)2-1-3-15(10-11)5-4-14-6-8-16-9-7-14/h1-10H2
InChIKeyQTZVYEYHRGRVDG-UHFFFAOYSA-N
MW234.29 g/mol
LogP1.05
Rot. Bonds3

About 4-[2-(3,3-difluoropiperidin-1-yl)ethyl]morpholine

4-[2-(3,3-difluoropiperidin-1-yl)ethyl]morpholine (PubChem CID 117007662) has the molecular formula C11H20F2N2O and a molecular weight of 234.29 g/mol. Its IUPAC name is 4-[2-(3,3-difluoropiperidin-1-yl)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(3,3-difluoropiperidin-1-yl)ethyl]morpholine
PubChem CID117007662
Molecular FormulaC11H20F2N2O
Molecular Weight234.29 g/mol
Exact Mass234.15
IUPAC Name4-[2-(3,3-difluoropiperidin-1-yl)ethyl]morpholine
SMILESFC1(F)CCCN(CCN2CCOCC2)C1
InChIInChI=1S/C11H20F2N2O/c12-11(13)2-1-3-15(10-11)5-4-14-6-8-16-9-7-14/h1-10H2
InChIKeyQTZVYEYHRGRVDG-UHFFFAOYSA-N
XLogP1.05
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.29
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-[4-(2,2-Difluoroethyl)-3-ethylpiperazin-1-yl]ethyl]morpholine
CID 75437493
1-[2-(2-Piperidin-1-ylethoxy)ethyl]piperidine
CID 22111401
1-[2-(2,2,2-Trifluoroethoxy)ethyl]piperidine
CID 59204082
1-[2-(2,2,3,3,3-Pentafluoropropoxy)ethyl]piperidine
CID 59204094
1-[2-(3,3,3-Trifluoropropoxy)ethyl]piperidine
CID 69555315
4-(1,1,2,2,3,3,4,4,5,5,6,6-Dodecafluoro-6-morpholin-4-ylhexyl)morpholine
CID 88452557
4-[3-(4,4-Difluoropiperidin-1-yl)-2,3-dimethylbutan-2-yl]morpholine
CID 130420370
1-Methyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-ium
CID 134276379
4-[(4,4-Difluoropiperidin-1-yl)methyl]morpholine
CID 141217769
1-[(2S)-2-[(2S)-3-(4,4-difluoropiperidin-1-yl)-1,1,1-trifluoropropan-2-yl]oxy-3,3,3-trifluoropropyl]-4,4-difluoropiperidine;hydrochloride
CID 142768060
4,4-Difluoro-1-methylpiperidine;ethane;2-ethyl-4-methylmorpholine
CID 144926144
1-[2-(2,2-Difluoroethoxy)ethyl]-1-methylpiperidin-1-ium
CID 158593106

Frequently Asked Questions

What is the IUPAC name of 4-[2-(3,3-difluoropiperidin-1-yl)ethyl]morpholine?
The IUPAC name of 4-[2-(3,3-difluoropiperidin-1-yl)ethyl]morpholine (CID 117007662) is 4-[2-(3,3-difluoropiperidin-1-yl)ethyl]morpholine.
What is the SMILES notation for 4-[2-(3,3-difluoropiperidin-1-yl)ethyl]morpholine?
The canonical SMILES for 4-[2-(3,3-difluoropiperidin-1-yl)ethyl]morpholine is FC1(F)CCCN(CCN2CCOCC2)C1.
What is the InChIKey of 4-[2-(3,3-difluoropiperidin-1-yl)ethyl]morpholine?
The InChIKey is QTZVYEYHRGRVDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F2N2O/c12-11(13)2-1-3-15(10-11)5-4-14-6-8-16-9-7-14/h1-10H2.
What are the key properties of 4-[2-(3,3-difluoropiperidin-1-yl)ethyl]morpholine?
4-[2-(3,3-difluoropiperidin-1-yl)ethyl]morpholine has a molecular weight of 234.29 g/mol, XLogP of 1.05, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(3,3-difluoropiperidin-1-yl)ethyl]morpholine is sourced from PubChem (CID 117007662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).