(3R)-3-(phenoxymethyl)pyrrolidine

C11H15NO — CID 26192487

IUPAC(3R)-3-(phenoxymethyl)pyrrolidine
SMILESc1ccc(OC[C@@H]2CCNC2)cc1
InChIInChI=1S/C11H15NO/c1-2-4-11(5-3-1)13-9-10-6-7-12-8-10/h1-5,10,12H,6-9H2/t10-/m1/s1
InChIKeySFQSAOHZCPJACU-SNVBAGLBSA-N
MW177.25 g/mol
LogP1.67
Rot. Bonds3

About (3R)-3-(phenoxymethyl)pyrrolidine

(3R)-3-(phenoxymethyl)pyrrolidine (PubChem CID 26192487) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is (3R)-3-(phenoxymethyl)pyrrolidine.

Molecular Properties

Compound Name(3R)-3-(phenoxymethyl)pyrrolidine
PubChem CID26192487
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name(3R)-3-(phenoxymethyl)pyrrolidine
SMILESc1ccc(OC[C@@H]2CCNC2)cc1
InChIInChI=1S/C11H15NO/c1-2-4-11(5-3-1)13-9-10-6-7-12-8-10/h1-5,10,12H,6-9H2/t10-/m1/s1
InChIKeySFQSAOHZCPJACU-SNVBAGLBSA-N
XLogP1.67
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-(phenoxymethyl)piperidine
CID 26190643
3-(2-phenoxyethoxymethyl)pyrrolidine
CID 56829876
(3R)-3-[(4-ethoxyphenoxy)methyl]pyrrolidine
CID 86321325
3-[(4-ethoxyphenoxy)methyl]pyrrolidine;hydrochloride
CID 56830321
3-[(3-chlorophenoxy)methyl]pyrrolidine
CID 56830207
3-[(3-bromophenoxy)methyl]pyrrolidine
CID 56830201
(3S)-3-[(4-phenylphenoxy)methyl]piperidine
CID 42427138
(3R)-3-[[4-(trifluoromethyl)phenoxy]methyl]pyrrolidine
CID 58737388
(3S)-3-[(3-ethylphenoxy)methyl]pyrrolidine;hydrochloride
CID 165429467
5-(phenoxymethyl)-3-(pyrrolidin-3-ylmethoxy)-1,2-oxazole
CID 175141401
cyclopropylmethoxybenzene
CID 12712156
(2S)-2-(phenoxymethyl)piperazine
CID 155904639

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(phenoxymethyl)pyrrolidine?
The IUPAC name of (3R)-3-(phenoxymethyl)pyrrolidine (CID 26192487) is (3R)-3-(phenoxymethyl)pyrrolidine.
What is the SMILES notation for (3R)-3-(phenoxymethyl)pyrrolidine?
The canonical SMILES for (3R)-3-(phenoxymethyl)pyrrolidine is c1ccc(OC[C@@H]2CCNC2)cc1.
What is the InChIKey of (3R)-3-(phenoxymethyl)pyrrolidine?
The InChIKey is SFQSAOHZCPJACU-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H15NO/c1-2-4-11(5-3-1)13-9-10-6-7-12-8-10/h1-5,10,12H,6-9H2/t10-/m1/s1.
What are the key properties of (3R)-3-(phenoxymethyl)pyrrolidine?
(3R)-3-(phenoxymethyl)pyrrolidine has a molecular weight of 177.25 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(phenoxymethyl)pyrrolidine is sourced from PubChem (CID 26192487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).