4-[(3-fluoropyrrolidin-3-yl)methyl]morpholine

C9H17FN2O — CID 84661567

IUPAC4-[(3-fluoropyrrolidin-3-yl)methyl]morpholine
SMILESFC1(CN2CCOCC2)CCNC1
InChIInChI=1S/C9H17FN2O/c10-9(1-2-11-7-9)8-12-3-5-13-6-4-12/h11H,1-8H2
InChIKeyUPBYFEVTMHESSC-UHFFFAOYSA-N
MW188.25 g/mol
LogP0.02
Rot. Bonds2

About 4-[(3-fluoropyrrolidin-3-yl)methyl]morpholine

4-[(3-fluoropyrrolidin-3-yl)methyl]morpholine (PubChem CID 84661567) has the molecular formula C9H17FN2O and a molecular weight of 188.25 g/mol. Its IUPAC name is 4-[(3-fluoropyrrolidin-3-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[(3-fluoropyrrolidin-3-yl)methyl]morpholine
PubChem CID84661567
Molecular FormulaC9H17FN2O
Molecular Weight188.25 g/mol
Exact Mass188.13
IUPAC Name4-[(3-fluoropyrrolidin-3-yl)methyl]morpholine
SMILESFC1(CN2CCOCC2)CCNC1
InChIInChI=1S/C9H17FN2O/c10-9(1-2-11-7-9)8-12-3-5-13-6-4-12/h11H,1-8H2
InChIKeyUPBYFEVTMHESSC-UHFFFAOYSA-N
XLogP0.02
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.25
LogP ≤ 50.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(Pyrrolidin-3-yl)methyl]morpholine
CID 14627371
{1-[2-(Morpholin-4-yl)ethyl]pyrrolidin-3-yl}methanamine
CID 24703103
Morpholine, 4-(4-methyl-3-pyrrolidinyl)-
CID 73994640
4-{[(3R)-pyrrolidin-3-yl]methyl}morpholine
CID 86311657
4-{[(3S)-pyrrolidin-3-yl]methyl}morpholine
CID 86311659
9-Methyl-6-oxa-2,9-diazaspiro[4.5]decane dihydrochloride
CID 75530777
4-(3-Methylpyrrolidin-3-yl)morpholine
CID 102921108
9-Methyl-6-oxa-2,9-diazaspiro[4.5]decane
CID 68627953
(2R)-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine
CID 156700817
(2R)-2-[2-[(3R)-3-fluoropyrrolidin-1-yl]ethyl]-2-methylmorpholine
CID 156700831
N-[(1-ethylpyrrolidin-3-yl)methyl]-2-(2,2,2-trifluoroethoxy)ethanamine
CID 54961701
N-[(1-methylpyrrolidin-3-yl)methyl]-2-(2,2,2-trifluoroethoxy)ethanamine
CID 61490349

Frequently Asked Questions

What is the IUPAC name of 4-[(3-fluoropyrrolidin-3-yl)methyl]morpholine?
The IUPAC name of 4-[(3-fluoropyrrolidin-3-yl)methyl]morpholine (CID 84661567) is 4-[(3-fluoropyrrolidin-3-yl)methyl]morpholine.
What is the SMILES notation for 4-[(3-fluoropyrrolidin-3-yl)methyl]morpholine?
The canonical SMILES for 4-[(3-fluoropyrrolidin-3-yl)methyl]morpholine is FC1(CN2CCOCC2)CCNC1.
What is the InChIKey of 4-[(3-fluoropyrrolidin-3-yl)methyl]morpholine?
The InChIKey is UPBYFEVTMHESSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17FN2O/c10-9(1-2-11-7-9)8-12-3-5-13-6-4-12/h11H,1-8H2.
What are the key properties of 4-[(3-fluoropyrrolidin-3-yl)methyl]morpholine?
4-[(3-fluoropyrrolidin-3-yl)methyl]morpholine has a molecular weight of 188.25 g/mol, XLogP of 0.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-fluoropyrrolidin-3-yl)methyl]morpholine is sourced from PubChem (CID 84661567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).