(3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine

C7H12F3NO — CID 82955468

IUPAC(3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine
SMILESFC(F)(F)CCO[C@@H]1CCNC1
InChIInChI=1S/C7H12F3NO/c8-7(9,10)2-4-12-6-1-3-11-5-6/h6,11H,1-5H2/t6-/m1/s1
InChIKeyZQNUGIYEZJGZNM-ZCFIWIBFSA-N
MW183.17 g/mol
LogP1.32
Rot. Bonds3

About (3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine

(3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine (PubChem CID 82955468) has the molecular formula C7H12F3NO and a molecular weight of 183.17 g/mol. Its IUPAC name is (3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine.

Molecular Properties

Compound Name(3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine
PubChem CID82955468
Molecular FormulaC7H12F3NO
Molecular Weight183.17 g/mol
Exact Mass183.09
IUPAC Name(3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine
SMILESFC(F)(F)CCO[C@@H]1CCNC1
InChIInChI=1S/C7H12F3NO/c8-7(9,10)2-4-12-6-1-3-11-5-6/h6,11H,1-5H2/t6-/m1/s1
InChIKeyZQNUGIYEZJGZNM-ZCFIWIBFSA-N
XLogP1.32
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.17
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3,3,3-trifluoropropoxy)piperidine;hydrochloride
CID 86775442
(3R)-3-(2-cyclopropylethoxy)pyrrolidine
CID 97000060
(3S)-3-(2-cyclobutylethoxy)pyrrolidine
CID 106201873
(3R)-3-propoxypyrrolidine;hydrochloride
CID 138393556
3-(2-methoxyethoxy)pyrrolidine
CID 18337162
(3R)-3-(2-cyclohexylethoxy)pyrrolidine
CID 26191806
6-[(3R)-pyrrolidin-3-yl]oxyhexan-1-amine
CID 146427989
3-ethoxypyrrolidine
CID 21333172
(3S)-3-ethoxypyrrolidine
CID 11116030
(3R)-3-(4-methylpentoxy)pyrrolidine
CID 115460364
(3R)-3-(2-propoxyethoxy)pyrrolidine
CID 86322695
3-[2-(4-fluorophenyl)ethoxy]pyrrolidine
CID 115070535

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine?
The IUPAC name of (3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine (CID 82955468) is (3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine.
What is the SMILES notation for (3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine?
The canonical SMILES for (3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine is FC(F)(F)CCO[C@@H]1CCNC1.
What is the InChIKey of (3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine?
The InChIKey is ZQNUGIYEZJGZNM-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H12F3NO/c8-7(9,10)2-4-12-6-1-3-11-5-6/h6,11H,1-5H2/t6-/m1/s1.
What are the key properties of (3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine?
(3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine has a molecular weight of 183.17 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(3,3,3-trifluoropropoxy)pyrrolidine is sourced from PubChem (CID 82955468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).