2-[(2-bromophenyl)methyl]-2-cyclopropylpyrrolidine

C14H18BrN — CID 66468305

IUPAC2-[(2-bromophenyl)methyl]-2-cyclopropylpyrrolidine
SMILESBrc1ccccc1CC1(C2CC2)CCCN1
InChIInChI=1S/C14H18BrN/c15-13-5-2-1-4-11(13)10-14(12-6-7-12)8-3-9-16-14/h1-2,4-5,12,16H,3,6-10H2
InChIKeyDJRCJSLFZDOTAP-UHFFFAOYSA-N
MW280.21 g/mol
LogP3.52
Rot. Bonds3

About 2-[(2-bromophenyl)methyl]-2-cyclopropylpyrrolidine

2-[(2-bromophenyl)methyl]-2-cyclopropylpyrrolidine (PubChem CID 66468305) has the molecular formula C14H18BrN and a molecular weight of 280.21 g/mol. Its IUPAC name is 2-[(2-bromophenyl)methyl]-2-cyclopropylpyrrolidine.

Molecular Properties

Compound Name2-[(2-bromophenyl)methyl]-2-cyclopropylpyrrolidine
PubChem CID66468305
Molecular FormulaC14H18BrN
Molecular Weight280.21 g/mol
Exact Mass279.06
IUPAC Name2-[(2-bromophenyl)methyl]-2-cyclopropylpyrrolidine
SMILESBrc1ccccc1CC1(C2CC2)CCCN1
InChIInChI=1S/C14H18BrN/c15-13-5-2-1-4-11(13)10-14(12-6-7-12)8-3-9-16-14/h1-2,4-5,12,16H,3,6-10H2
InChIKeyDJRCJSLFZDOTAP-UHFFFAOYSA-N
XLogP3.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.21
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(2-chlorophenyl)methyl]-2-cyclopropylpyrrolidine
CID 66468538
2-[(5-bromo-2-fluorophenyl)methyl]-2-cyclopropylpyrrolidine
CID 66466031
2-[(2-bromo-4-fluorophenyl)methyl]-2-cyclopropylazepane
CID 79117461
2-[(4-chloro-2-fluorophenyl)methyl]-2-cyclopropylpyrrolidine
CID 114856133
2-[(3-chlorophenyl)methyl]-2-cyclopropylpyrrolidine
CID 66466260
2-[(2-bromophenyl)methyl]-2-ethylpiperidine
CID 115058886
2-[(3-bromo-5-fluorophenyl)methyl]-2-cyclopropylpyrrolidine
CID 79708745
2-cyclopropyl-2-[(3,4-dimethylphenyl)methyl]pyrrolidine
CID 66466946
2-[(3-bromo-5-fluorophenyl)methyl]-2-cyclopropylazepane
CID 79708908
2-[(2-bromophenyl)methyl]piperidine-2-carboxylic acid
CID 115103755
2-[(2-cyclopropylazepan-2-yl)methyl]-1,3-benzothiazole
CID 79826728
2-[(2-chloro-4-methylphenyl)methyl]-2-cyclopropylazepane
CID 106868498

Frequently Asked Questions

What is the IUPAC name of 2-[(2-bromophenyl)methyl]-2-cyclopropylpyrrolidine?
The IUPAC name of 2-[(2-bromophenyl)methyl]-2-cyclopropylpyrrolidine (CID 66468305) is 2-[(2-bromophenyl)methyl]-2-cyclopropylpyrrolidine.
What is the SMILES notation for 2-[(2-bromophenyl)methyl]-2-cyclopropylpyrrolidine?
The canonical SMILES for 2-[(2-bromophenyl)methyl]-2-cyclopropylpyrrolidine is Brc1ccccc1CC1(C2CC2)CCCN1.
What is the InChIKey of 2-[(2-bromophenyl)methyl]-2-cyclopropylpyrrolidine?
The InChIKey is DJRCJSLFZDOTAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18BrN/c15-13-5-2-1-4-11(13)10-14(12-6-7-12)8-3-9-16-14/h1-2,4-5,12,16H,3,6-10H2.
What are the key properties of 2-[(2-bromophenyl)methyl]-2-cyclopropylpyrrolidine?
2-[(2-bromophenyl)methyl]-2-cyclopropylpyrrolidine has a molecular weight of 280.21 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-bromophenyl)methyl]-2-cyclopropylpyrrolidine is sourced from PubChem (CID 66468305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).