(2R)-2-(2,5-dibromophenyl)pyrrolidine

C10H11Br2N — CID 131190573

IUPAC(2R)-2-(2,5-dibromophenyl)pyrrolidine
SMILESBrc1ccc(Br)c([C@H]2CCCN2)c1
InChIInChI=1S/C10H11Br2N/c11-7-3-4-9(12)8(6-7)10-2-1-5-13-10/h3-4,6,10,13H,1-2,5H2/t10-/m1/s1
InChIKeyBEHCLHSTIWCBCJ-SNVBAGLBSA-N
MW305.01 g/mol
LogP3.64
Rot. Bonds1

About (2R)-2-(2,5-dibromophenyl)pyrrolidine

(2R)-2-(2,5-dibromophenyl)pyrrolidine (PubChem CID 131190573) has the molecular formula C10H11Br2N and a molecular weight of 305.01 g/mol. Its IUPAC name is (2R)-2-(2,5-dibromophenyl)pyrrolidine.

Molecular Properties

Compound Name(2R)-2-(2,5-dibromophenyl)pyrrolidine
PubChem CID131190573
Molecular FormulaC10H11Br2N
Molecular Weight305.01 g/mol
Exact Mass302.93
IUPAC Name(2R)-2-(2,5-dibromophenyl)pyrrolidine
SMILESBrc1ccc(Br)c([C@H]2CCCN2)c1
InChIInChI=1S/C10H11Br2N/c11-7-3-4-9(12)8(6-7)10-2-1-5-13-10/h3-4,6,10,13H,1-2,5H2/t10-/m1/s1
InChIKeyBEHCLHSTIWCBCJ-SNVBAGLBSA-N
XLogP3.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.01
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,5-dibromophenyl)pyrrolidine?
The IUPAC name of (2R)-2-(2,5-dibromophenyl)pyrrolidine (CID 131190573) is (2R)-2-(2,5-dibromophenyl)pyrrolidine.
What is the SMILES notation for (2R)-2-(2,5-dibromophenyl)pyrrolidine?
The canonical SMILES for (2R)-2-(2,5-dibromophenyl)pyrrolidine is Brc1ccc(Br)c([C@H]2CCCN2)c1.
What is the InChIKey of (2R)-2-(2,5-dibromophenyl)pyrrolidine?
The InChIKey is BEHCLHSTIWCBCJ-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H11Br2N/c11-7-3-4-9(12)8(6-7)10-2-1-5-13-10/h3-4,6,10,13H,1-2,5H2/t10-/m1/s1.
What are the key properties of (2R)-2-(2,5-dibromophenyl)pyrrolidine?
(2R)-2-(2,5-dibromophenyl)pyrrolidine has a molecular weight of 305.01 g/mol, XLogP of 3.64, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,5-dibromophenyl)pyrrolidine is sourced from PubChem (CID 131190573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).