2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide

C12H15BrN2O — CID 118740670

IUPAC2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide
SMILESNC(=O)CN1CCCC1c1ccccc1Br
InChIInChI=1S/C12H15BrN2O/c13-10-5-2-1-4-9(10)11-6-3-7-15(11)8-12(14)16/h1-2,4-5,11H,3,6-8H2,(H2,14,16)
InChIKeyNOHWHVVYWRTKFK-UHFFFAOYSA-N
MW283.17 g/mol
LogP2.07
Rot. Bonds3

About 2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide

2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide (PubChem CID 118740670) has the molecular formula C12H15BrN2O and a molecular weight of 283.17 g/mol. Its IUPAC name is 2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide
PubChem CID118740670
Molecular FormulaC12H15BrN2O
Molecular Weight283.17 g/mol
Exact Mass282.04
IUPAC Name2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide
SMILESNC(=O)CN1CCCC1c1ccccc1Br
InChIInChI=1S/C12H15BrN2O/c13-10-5-2-1-4-9(10)11-6-3-7-15(11)8-12(14)16/h1-2,4-5,11H,3,6-8H2,(H2,14,16)
InChIKeyNOHWHVVYWRTKFK-UHFFFAOYSA-N
XLogP2.07
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.17
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-N-[(2-bromo-4-fluorophenyl)methyl]-1-methyl-5-oxopyrrolidine-2-carboxamide
CID 67458149
(2S)-N-[(2-bromophenyl)methyl]-1-ethyl-5-oxopyrrolidine-2-carboxamide
CID 67460094
3-(2-Bromophenyl)piperazin-2-one
CID 62352289
2-((3-Bromobenzyl)(isopropyl)amino)acetamide
CID 56810079
3-[2-(2-bromophenyl)pyrrolidin-1-yl]-N-methylpropanamide
CID 75425681
2-[(2-Bromo-4-cyanophenyl)methyl-cyclopentylamino]acetamide
CID 84597824
2-[2-(2-bromophenyl)pyrrolidin-1-yl]-N-methylacetamide
CID 118740669
2-(2-Phenylpyrrolidin-1-yl)acetamide
CID 42931774
3-((2-Bromobenzyl)(methyl)amino)propanamide
CID 17477682
N-[(2-bromo-6-fluorophenyl)methyl]-N',N'-di(propan-2-yl)oxamide
CID 122224394
N-[(2-bromophenyl)methyl]-N',N'-di(propan-2-yl)oxamide
CID 155669981
2-[(2-Bromophenyl)methyl-propan-2-ylamino]acetamide
CID 8538905

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide?
The IUPAC name of 2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide (CID 118740670) is 2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide.
What is the SMILES notation for 2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide?
The canonical SMILES for 2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide is NC(=O)CN1CCCC1c1ccccc1Br.
What is the InChIKey of 2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide?
The InChIKey is NOHWHVVYWRTKFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15BrN2O/c13-10-5-2-1-4-9(10)11-6-3-7-15(11)8-12(14)16/h1-2,4-5,11H,3,6-8H2,(H2,14,16).
What are the key properties of 2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide?
2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide has a molecular weight of 283.17 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-bromophenyl)pyrrolidin-1-yl]acetamide is sourced from PubChem (CID 118740670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).