(2R)-2-(6-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine

C13H16ClN — CID 66519430

IUPAC(2R)-2-(6-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine
SMILESClc1cc2c(cc1[C@H]1CCCN1)CCC2
InChIInChI=1S/C13H16ClN/c14-12-8-10-4-1-3-9(10)7-11(12)13-5-2-6-15-13/h7-8,13,15H,1-6H2/t13-/m1/s1
InChIKeyXYZBEGVMNWTFBA-CYBMUJFWSA-N
MW221.73 g/mol
LogP3.25
Rot. Bonds1

About (2R)-2-(6-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine

(2R)-2-(6-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine (PubChem CID 66519430) has the molecular formula C13H16ClN and a molecular weight of 221.73 g/mol. Its IUPAC name is (2R)-2-(6-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine.

Molecular Properties

Compound Name(2R)-2-(6-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine
PubChem CID66519430
Molecular FormulaC13H16ClN
Molecular Weight221.73 g/mol
Exact Mass221.10
IUPAC Name(2R)-2-(6-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine
SMILESClc1cc2c(cc1[C@H]1CCCN1)CCC2
InChIInChI=1S/C13H16ClN/c14-12-8-10-4-1-3-9(10)7-11(12)13-5-2-6-15-13/h7-8,13,15H,1-6H2/t13-/m1/s1
InChIKeyXYZBEGVMNWTFBA-CYBMUJFWSA-N
XLogP3.25
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.73
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 117338941
(2S)-2-(7-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine
CID 66519431
3-chloro-4-pyrrolidin-2-ylphenol
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3-chloro-4-[(2S)-pyrrolidin-2-yl]phenol
CID 55252487
2-(6-chloro-4H-1,3-benzodioxin-7-yl)piperidine
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5-chloro-2-methoxy-4-[(2S)-pyrrolidin-2-yl]aniline
CID 66519127
(2R)-2-(4-bromo-2-chlorophenyl)pyrrolidine;hydrochloride
CID 171195907
2-(2-chloro-4-fluorophenyl)pyrrolidine;hydrochloride
CID 77131964
2-(4-chloro-3-methoxy-5,6,7,8-tetrahydronaphthalen-2-yl)pyrrolidine
CID 117418762
(2S)-2-(6-fluoro-2,3-dihydro-1H-inden-4-yl)pyrrolidine
CID 66519043
2-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)piperidine
CID 117387275
(2S)-2-(4-chlorothiophen-3-yl)pyrrolidine
CID 130648179

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(6-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine?
The IUPAC name of (2R)-2-(6-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine (CID 66519430) is (2R)-2-(6-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine.
What is the SMILES notation for (2R)-2-(6-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine?
The canonical SMILES for (2R)-2-(6-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine is Clc1cc2c(cc1[C@H]1CCCN1)CCC2.
What is the InChIKey of (2R)-2-(6-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine?
The InChIKey is XYZBEGVMNWTFBA-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H16ClN/c14-12-8-10-4-1-3-9(10)7-11(12)13-5-2-6-15-13/h7-8,13,15H,1-6H2/t13-/m1/s1.
What are the key properties of (2R)-2-(6-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine?
(2R)-2-(6-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine has a molecular weight of 221.73 g/mol, XLogP of 3.25, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(6-chloro-2,3-dihydro-1H-inden-5-yl)pyrrolidine is sourced from PubChem (CID 66519430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).