(2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine

C11H21FN2O — CID 156700817

IUPAC(2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine
SMILESC[C@@]1(CCN2CC[C@H](F)C2)CNCCO1
InChIInChI=1S/C11H21FN2O/c1-11(9-13-4-7-15-11)3-6-14-5-2-10(12)8-14/h10,13H,2-9H2,1H3/t10-,11+/m0/s1
InChIKeyCDQUEIVWWBGRGR-WDEREUQCSA-N
MW216.30 g/mol
LogP0.80
Rot. Bonds3

About (2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine

(2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine (PubChem CID 156700817) has the molecular formula C11H21FN2O and a molecular weight of 216.30 g/mol. Its IUPAC name is (2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine.

Molecular Properties

Compound Name(2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine
PubChem CID156700817
Molecular FormulaC11H21FN2O
Molecular Weight216.30 g/mol
Exact Mass216.16
IUPAC Name(2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine
SMILESC[C@@]1(CCN2CC[C@H](F)C2)CNCCO1
InChIInChI=1S/C11H21FN2O/c1-11(9-13-4-7-15-11)3-6-14-5-2-10(12)8-14/h10,13H,2-9H2,1H3/t10-,11+/m0/s1
InChIKeyCDQUEIVWWBGRGR-WDEREUQCSA-N
XLogP0.80
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.30
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

9-Methyl-6-oxa-2,9-diazaspiro[4.5]decane dihydrochloride
CID 75530777
1-Methyl-4-(pyrrolidin-3-yloxy)piperidine dihydrochloride
CID 117046275
9-Methyl-6-oxa-2,9-diazaspiro[4.5]decane
CID 68627953
2,2-difluoro-N-[2-(2-methylmorpholin-2-yl)ethyl]ethanamine
CID 156700819
2,2,2-trifluoro-N-[2-(2-methylmorpholin-2-yl)ethyl]ethanamine
CID 156700825
2,2-difluoro-N-methyl-N-[2-(2-methylmorpholin-2-yl)ethyl]ethanamine
CID 156700828
(2R)-2-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine
CID 156700831
2-[2-(3,3-Difluoroazetidin-1-yl)ethyl]-2-methylmorpholine
CID 156700834
(3R,4S)-3-fluoro-1,4-dimethyl-5-[(3R)-pyrrolidin-3-yl]oxypiperidine
CID 163829316
N-[2-[4-(2-fluoroethyl)morpholin-2-yl]ethyl]-2-methylpropan-2-amine
CID 167228176
4-[(3-Fluoropyrrolidin-3-yl)methyl]morpholine
CID 84661567
4-[2-(3-Fluoropyrrolidin-3-yl)ethyl]morpholine
CID 84721494

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine?
The IUPAC name of (2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine (CID 156700817) is (2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine.
What is the SMILES notation for (2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine?
The canonical SMILES for (2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine is C[C@@]1(CCN2CC[C@H](F)C2)CNCCO1.
What is the InChIKey of (2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine?
The InChIKey is CDQUEIVWWBGRGR-WDEREUQCSA-N. The full InChI is InChI=1S/C11H21FN2O/c1-11(9-13-4-7-15-11)3-6-14-5-2-10(12)8-14/h10,13H,2-9H2,1H3/t10-,11+/m0/s1.
What are the key properties of (2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine?
(2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine has a molecular weight of 216.30 g/mol, XLogP of 0.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine is sourced from PubChem (CID 156700817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).