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

C13H16BrN — CID 83913423

IUPAC3-[1-(3-bromophenyl)cyclopropyl]pyrrolidine
SMILESBrc1cccc(C2(C3CCNC3)CC2)c1
InChIInChI=1S/C13H16BrN/c14-12-3-1-2-10(8-12)13(5-6-13)11-4-7-15-9-11/h1-3,8,11,15H,4-7,9H2
InChIKeyYVHLXNFJLGGTAB-UHFFFAOYSA-N
MW266.18 g/mol
LogP3.09
Rot. Bonds2

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

3-[1-(3-bromophenyl)cyclopropyl]pyrrolidine (PubChem CID 83913423) has the molecular formula C13H16BrN and a molecular weight of 266.18 g/mol. Its IUPAC name is 3-[1-(3-bromophenyl)cyclopropyl]pyrrolidine.

Molecular Properties

Compound Name3-[1-(3-bromophenyl)cyclopropyl]pyrrolidine
PubChem CID83913423
Molecular FormulaC13H16BrN
Molecular Weight266.18 g/mol
Exact Mass265.05
IUPAC Name3-[1-(3-bromophenyl)cyclopropyl]pyrrolidine
SMILESBrc1cccc(C2(C3CCNC3)CC2)c1
InChIInChI=1S/C13H16BrN/c14-12-3-1-2-10(8-12)13(5-6-13)11-4-7-15-9-11/h1-3,8,11,15H,4-7,9H2
InChIKeyYVHLXNFJLGGTAB-UHFFFAOYSA-N
XLogP3.09
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 ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-[1-(3-chlorophenyl)cyclopropyl]pyrrolidine
CID 83910690
2-[1-(3-bromophenyl)cyclopropyl]pyrrolidine
CID 83913426
3-(1-phenylcyclopropyl)piperidine;hydrochloride
CID 162342001
4-phenyl-4-pyrrolidin-3-ylcyclohexan-1-one
CID 57475104
3-(1-pyrrolidin-3-ylcyclopentyl)pyridine
CID 83910049
3-(3-bromophenyl)sulfanylpyrrolidine
CID 62803924
1-(3-bromophenyl)-N-pyrrolidin-3-ylcyclohexane-1-carboxamide;hydrochloride
CID 119452370
1-(3-bromophenyl)-N-methyl-N-pyrrolidin-3-ylcyclopentane-1-carboxamide
CID 119551309
1-(3-bromophenyl)-N-(3-methylpiperidin-4-yl)cyclopropane-1-carboxamide
CID 120555475
3-[1-(4-bromophenyl)cyclopropyl]azetidine;hydrochloride
CID 155819891
2-(3-bromophenyl)-5-methylsulfanyl-2-piperidin-4-ylimidazol-4-amine
CID 66847506
[3-(2,3,4,5,6,7,8,8a-octahydro-1H-cyclopenta[c]azepin-5a-yl)phenyl] acetate
CID 21330525

Frequently Asked Questions

What is the IUPAC name of 3-[1-(3-bromophenyl)cyclopropyl]pyrrolidine?
The IUPAC name of 3-[1-(3-bromophenyl)cyclopropyl]pyrrolidine (CID 83913423) is 3-[1-(3-bromophenyl)cyclopropyl]pyrrolidine.
What is the SMILES notation for 3-[1-(3-bromophenyl)cyclopropyl]pyrrolidine?
The canonical SMILES for 3-[1-(3-bromophenyl)cyclopropyl]pyrrolidine is Brc1cccc(C2(C3CCNC3)CC2)c1.
What is the InChIKey of 3-[1-(3-bromophenyl)cyclopropyl]pyrrolidine?
The InChIKey is YVHLXNFJLGGTAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16BrN/c14-12-3-1-2-10(8-12)13(5-6-13)11-4-7-15-9-11/h1-3,8,11,15H,4-7,9H2.
What are the key properties of 3-[1-(3-bromophenyl)cyclopropyl]pyrrolidine?
3-[1-(3-bromophenyl)cyclopropyl]pyrrolidine has a molecular weight of 266.18 g/mol, XLogP of 3.09, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(3-bromophenyl)cyclopropyl]pyrrolidine is sourced from PubChem (CID 83913423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).