(3R)-3-(difluoromethoxymethyl)pyrrolidine

C6H11F2NO — CID 124594474

IUPAC(3R)-3-(difluoromethoxymethyl)pyrrolidine
SMILESFC(F)OC[C@@H]1CCNC1
InChIInChI=1S/C6H11F2NO/c7-6(8)10-4-5-1-2-9-3-5/h5-6,9H,1-4H2/t5-/m1/s1
InChIKeyVMUMALCEPHRWIF-RXMQYKEDSA-N
MW151.16 g/mol
LogP0.84
Rot. Bonds3

About (3R)-3-(difluoromethoxymethyl)pyrrolidine

(3R)-3-(difluoromethoxymethyl)pyrrolidine (PubChem CID 124594474) has the molecular formula C6H11F2NO and a molecular weight of 151.16 g/mol. Its IUPAC name is (3R)-3-(difluoromethoxymethyl)pyrrolidine.

Molecular Properties

Compound Name(3R)-3-(difluoromethoxymethyl)pyrrolidine
PubChem CID124594474
Molecular FormulaC6H11F2NO
Molecular Weight151.16 g/mol
Exact Mass151.08
IUPAC Name(3R)-3-(difluoromethoxymethyl)pyrrolidine
SMILESFC(F)OC[C@@H]1CCNC1
InChIInChI=1S/C6H11F2NO/c7-6(8)10-4-5-1-2-9-3-5/h5-6,9H,1-4H2/t5-/m1/s1
InChIKeyVMUMALCEPHRWIF-RXMQYKEDSA-N
XLogP0.84
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(Methoxymethyl)pyrrolidine
CID 22993433
3-(Ethoxymethyl)pyrrolidine
CID 45075569
3-(Methoxymethyl)pyrrolidine hydrochloride
CID 46735760
rac-((3R,4R)-4-(trifluoromethyl)pyrrolidin-3-yl)methanol
CID 70207388
(S)-3-(methoxymethyl)pyrrolidine hydrochloride
CID 71642900
3-[(Difluoromethoxy)methyl]pyrrolidine
CID 84716441
(R)-3-(Methoxymethyl)pyrrolidine hydrochloride
CID 91933778
(3S)-3-(methoxymethyl)-3-(trifluoromethyl)pyrrolidine
CID 129494946
(4-Trifluoromethyl-pyrrolidin-3-YL)-methanol hydrochloride
CID 22911440
[4-(Trifluoromethyl)pyrrolidin-3-yl]methanol
CID 22911441
((3R,4R)-4-(Trifluoromethyl)pyrrolidin-3-yl)methanol
CID 53817071
[(3R,4R)-4-(Trifluoromethyl)pyrrolidin-3-YL]methanol hydrochloride
CID 70207386

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(difluoromethoxymethyl)pyrrolidine?
The IUPAC name of (3R)-3-(difluoromethoxymethyl)pyrrolidine (CID 124594474) is (3R)-3-(difluoromethoxymethyl)pyrrolidine.
What is the SMILES notation for (3R)-3-(difluoromethoxymethyl)pyrrolidine?
The canonical SMILES for (3R)-3-(difluoromethoxymethyl)pyrrolidine is FC(F)OC[C@@H]1CCNC1.
What is the InChIKey of (3R)-3-(difluoromethoxymethyl)pyrrolidine?
The InChIKey is VMUMALCEPHRWIF-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H11F2NO/c7-6(8)10-4-5-1-2-9-3-5/h5-6,9H,1-4H2/t5-/m1/s1.
What are the key properties of (3R)-3-(difluoromethoxymethyl)pyrrolidine?
(3R)-3-(difluoromethoxymethyl)pyrrolidine has a molecular weight of 151.16 g/mol, XLogP of 0.84, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(difluoromethoxymethyl)pyrrolidine is sourced from PubChem (CID 124594474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).