2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine

C13H16BrN — CID 83913426

IUPAC2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine
SMILESBrc1cccc(C2(C3CCCN3)CC2)c1
InChIInChI=1S/C13H16BrN/c14-11-4-1-3-10(9-11)13(6-7-13)12-5-2-8-15-12/h1,3-4,9,12,15H,2,5-8H2
InChIKeyUYARSSFYQYGHML-UHFFFAOYSA-N
MW266.18 g/mol
LogP3.23
Rot. Bonds2

About 2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine

2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine (PubChem CID 83913426) has the molecular formula C13H16BrN and a molecular weight of 266.18 g/mol. Its IUPAC name is 2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine.

Molecular Properties

Compound Name2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine
PubChem CID83913426
Molecular FormulaC13H16BrN
Molecular Weight266.18 g/mol
Exact Mass265.05
IUPAC Name2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine
SMILESBrc1cccc(C2(C3CCCN3)CC2)c1
InChIInChI=1S/C13H16BrN/c14-11-4-1-3-10(9-11)13(6-7-13)12-5-2-8-15-12/h1,3-4,9,12,15H,2,5-8H2
InChIKeyUYARSSFYQYGHML-UHFFFAOYSA-N
XLogP3.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.18
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[1-(4-bromophenyl)cyclopropyl]pyrrolidine
CID 83913427
2-[1-(3-chlorophenyl)cyclobutyl]pyrrolidine
CID 83912096
3-[1-(3-bromophenyl)cyclopropyl]pyrrolidine
CID 83913423
3-(1-pyrrolidin-2-ylcyclohexyl)pyridine
CID 83911588
2-[1-(2,4-difluorophenyl)cyclopropyl]pyrrolidine
CID 83910817
N-[[1-(3-bromophenyl)cyclobutyl]methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119301103
N-[[1-(3-bromophenyl)cyclobutyl]methyl]-2-pyrrolidin-2-ylacetamide
CID 119744834
2-(3-bromophenyl)-2-methylpiperidin-3-ol;hydrochloride
CID 115054403
2-[1-(2,4-dimethylphenyl)cyclopropyl]pyrrolidine
CID 83909979
2-(3-bromophenyl)-2-propan-2-ylazepane
CID 115059411
1-(3-bromophenyl)cyclopropan-1-amine
CID 11127564
2-(4-bromophenyl)-2-[(2S)-pyrrolidin-2-yl]-1,3-dihydroimidazole;dihydrochloride
CID 155671299

Frequently Asked Questions

What is the IUPAC name of 2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine?
The IUPAC name of 2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine (CID 83913426) is 2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine.
What is the SMILES notation for 2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine?
The canonical SMILES for 2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine is Brc1cccc(C2(C3CCCN3)CC2)c1.
What is the InChIKey of 2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine?
The InChIKey is UYARSSFYQYGHML-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16BrN/c14-11-4-1-3-10(9-11)13(6-7-13)12-5-2-8-15-12/h1,3-4,9,12,15H,2,5-8H2.
What are the key properties of 2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine?
2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine has a molecular weight of 266.18 g/mol, XLogP of 3.23, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine is sourced from PubChem (CID 83913426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).