(2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine

C11H13F2NO — CID 165345527

IUPAC(2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine
SMILESCOc1ccc(F)c(F)c1[C@H]1CCCN1
InChIInChI=1S/C11H13F2NO/c1-15-9-5-4-7(12)11(13)10(9)8-3-2-6-14-8/h4-5,8,14H,2-3,6H2,1H3/t8-/m1/s1
InChIKeyOZYGNRQJKRFNFW-MRVPVSSYSA-N
MW213.23 g/mol
LogP2.40
Rot. Bonds2

About (2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine

(2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine (PubChem CID 165345527) has the molecular formula C11H13F2NO and a molecular weight of 213.23 g/mol. Its IUPAC name is (2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine.

Molecular Properties

Compound Name(2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine
PubChem CID165345527
Molecular FormulaC11H13F2NO
Molecular Weight213.23 g/mol
Exact Mass213.10
IUPAC Name(2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine
SMILESCOc1ccc(F)c(F)c1[C@H]1CCCN1
InChIInChI=1S/C11H13F2NO/c1-15-9-5-4-7(12)11(13)10(9)8-3-2-6-14-8/h4-5,8,14H,2-3,6H2,1H3/t8-/m1/s1
InChIKeyOZYGNRQJKRFNFW-MRVPVSSYSA-N
XLogP2.40
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.23
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(2,6-difluoro-3-methoxyphenyl)pyrrolidine;hydrochloride
CID 171196574
2-(3-bromo-2-fluoro-6-methoxyphenyl)piperidine
CID 84814358
2-(6-bromo-2-fluoro-3-methoxyphenyl)pyrrolidine
CID 84713802
2-(6-bromo-2-fluoro-3-methoxyphenyl)piperidine
CID 117465054
3,4-difluoro-6-methoxy-2-piperidin-2-ylphenol
CID 117359415
(2R)-2-(2,6-difluoro-3-methylphenyl)pyrrolidine
CID 66518496
2-(2-chloro-3,6-dimethoxyphenyl)piperidine
CID 117392632
2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine
CID 77131665
2-(2,6-difluoro-3-methylphenyl)pyrrolidine;hydrochloride
CID 138040825
(2S)-2-(5-fluoro-2-methoxyphenyl)pyrrolidine
CID 55277653
2-(3,4-difluoro-5-methoxyphenyl)pyrrolidine;hydrochloride
CID 146049321
2-(2-chloro-3-fluoro-5,6-dimethoxyphenyl)pyrrolidine
CID 117403489

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine?
The IUPAC name of (2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine (CID 165345527) is (2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine.
What is the SMILES notation for (2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine?
The canonical SMILES for (2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine is COc1ccc(F)c(F)c1[C@H]1CCCN1.
What is the InChIKey of (2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine?
The InChIKey is OZYGNRQJKRFNFW-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H13F2NO/c1-15-9-5-4-7(12)11(13)10(9)8-3-2-6-14-8/h4-5,8,14H,2-3,6H2,1H3/t8-/m1/s1.
What are the key properties of (2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine?
(2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine has a molecular weight of 213.23 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine is sourced from PubChem (CID 165345527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).