(3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide

C12H14Br2N2O — CID 81124356

IUPAC(3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide
SMILESO=C(Nc1cc(Br)ccc1Br)[C@@H]1CCCNC1
InChIInChI=1S/C12H14Br2N2O/c13-9-3-4-10(14)11(6-9)16-12(17)8-2-1-5-15-7-8/h3-4,6,8,15H,1-2,5,7H2,(H,16,17)/t8-/m1/s1
InChIKeyAPRKKVWCDBHKMY-MRVPVSSYSA-N
MW362.07 g/mol
LogP3.15
Rot. Bonds2

About (3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide

(3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide (PubChem CID 81124356) has the molecular formula C12H14Br2N2O and a molecular weight of 362.07 g/mol. Its IUPAC name is (3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide
PubChem CID81124356
Molecular FormulaC12H14Br2N2O
Molecular Weight362.07 g/mol
Exact Mass359.95
IUPAC Name(3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide
SMILESO=C(Nc1cc(Br)ccc1Br)[C@@H]1CCCNC1
InChIInChI=1S/C12H14Br2N2O/c13-9-3-4-10(14)11(6-9)16-12(17)8-2-1-5-15-7-8/h3-4,6,8,15H,1-2,5,7H2,(H,16,17)/t8-/m1/s1
InChIKeyAPRKKVWCDBHKMY-MRVPVSSYSA-N
XLogP3.15
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.07
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide 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

(3S)-N-(5-bromo-2-hydroxyphenyl)piperidine-3-carboxamide
CID 81135195
N-(4-bromo-2-chlorophenyl)piperidine-3-carboxamide
CID 43347399
(3S)-N-(5-bromo-2-methoxyphenyl)piperidine-3-carboxamide
CID 81140921
5-bromo-2-[[(3S)-piperidine-3-carbonyl]amino]benzoic acid
CID 81141287
(3R)-N-(4-bromo-2-nitrophenyl)piperidine-3-carboxamide
CID 81124120
(3S)-N-(2,4,6-tribromophenyl)piperidine-3-carboxamide
CID 28992192
N-(2-bromo-4-chlorophenyl)piperidine-3-carboxamide
CID 81263705
(3S)-N-(2-bromo-5-chloro-4-methylphenyl)piperidine-3-carboxamide
CID 104723644
N-(5-bromo-2-methoxyphenyl)pyrrolidine-3-carboxamide
CID 63006028
(3R)-N-(2-bromo-4-sulfamoylphenyl)piperidine-3-carboxamide
CID 81125256
(3S)-N-(2-bromo-4-sulfamoylphenyl)piperidine-3-carboxamide
CID 81125110
N-(4-bromo-2-fluorophenyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119673458

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide (CID 81124356) is (3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide is O=C(Nc1cc(Br)ccc1Br)[C@@H]1CCCNC1.
What is the InChIKey of (3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide?
The InChIKey is APRKKVWCDBHKMY-MRVPVSSYSA-N. The full InChI is InChI=1S/C12H14Br2N2O/c13-9-3-4-10(14)11(6-9)16-12(17)8-2-1-5-15-7-8/h3-4,6,8,15H,1-2,5,7H2,(H,16,17)/t8-/m1/s1.
What are the key properties of (3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide?
(3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide has a molecular weight of 362.07 g/mol, XLogP of 3.15, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(2,5-dibromophenyl)piperidine-3-carboxamide is sourced from PubChem (CID 81124356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).