N-[(2,4-dibromophenyl)methyl]cyclopentanamine

C12H15Br2N — CID 107938680

IUPACN-[(2,4-dibromophenyl)methyl]cyclopentanamine
SMILESBrc1ccc(CNC2CCCC2)c(Br)c1
InChIInChI=1S/C12H15Br2N/c13-10-6-5-9(12(14)7-10)8-15-11-3-1-2-4-11/h5-7,11,15H,1-4,8H2
InChIKeyRWDZVWGFLIIJTJ-UHFFFAOYSA-N
MW333.07 g/mol
LogP4.24
Rot. Bonds3

About N-[(2,4-dibromophenyl)methyl]cyclopentanamine

N-[(2,4-dibromophenyl)methyl]cyclopentanamine (PubChem CID 107938680) has the molecular formula C12H15Br2N and a molecular weight of 333.07 g/mol. Its IUPAC name is N-[(2,4-dibromophenyl)methyl]cyclopentanamine.

Molecular Properties

Compound NameN-[(2,4-dibromophenyl)methyl]cyclopentanamine
PubChem CID107938680
Molecular FormulaC12H15Br2N
Molecular Weight333.07 g/mol
Exact Mass330.96
IUPAC NameN-[(2,4-dibromophenyl)methyl]cyclopentanamine
SMILESBrc1ccc(CNC2CCCC2)c(Br)c1
InChIInChI=1S/C12H15Br2N/c13-10-6-5-9(12(14)7-10)8-15-11-3-1-2-4-11/h5-7,11,15H,1-4,8H2
InChIKeyRWDZVWGFLIIJTJ-UHFFFAOYSA-N
XLogP4.24
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.07
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[(2,4-dibromophenyl)methyl]cyclopentanamine 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

N-[(4-bromo-2-chlorophenyl)methyl]cyclopentanamine
CID 60984566
N-[(2,5-dibromophenyl)methyl]cyclobutanamine
CID 130682714
N-[(5-bromo-2-chlorophenyl)methyl]cyclobutanamine
CID 103793012
N-[(4-bromo-2-piperidin-1-ylphenyl)methyl]cyclopentanamine
CID 170453756
3-bromo-4-[(cycloheptylamino)methyl]benzoic acid
CID 103237239
N-[(5-bromo-2-methoxyphenyl)methyl]cycloheptanamine
CID 792004
N-[(2-bromo-5-chlorophenyl)methyl]cyclopentanamine
CID 66158673
N-[(4-bromophenyl)methyl]cyclopentanamine;hydrochloride
CID 17289669
N-[(4-bromophenyl)methyl]cycloheptanamine;hydrochloride
CID 17294485
N-[(6-bromoquinolin-4-yl)methyl]cyclobutanamine
CID 178046560
3-bromo-4-[(cyclopropylamino)methyl]benzoic acid
CID 103230289
N-[[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]cyclooctanamine
CID 4723049

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dibromophenyl)methyl]cyclopentanamine?
The IUPAC name of N-[(2,4-dibromophenyl)methyl]cyclopentanamine (CID 107938680) is N-[(2,4-dibromophenyl)methyl]cyclopentanamine.
What is the SMILES notation for N-[(2,4-dibromophenyl)methyl]cyclopentanamine?
The canonical SMILES for N-[(2,4-dibromophenyl)methyl]cyclopentanamine is Brc1ccc(CNC2CCCC2)c(Br)c1.
What is the InChIKey of N-[(2,4-dibromophenyl)methyl]cyclopentanamine?
The InChIKey is RWDZVWGFLIIJTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15Br2N/c13-10-6-5-9(12(14)7-10)8-15-11-3-1-2-4-11/h5-7,11,15H,1-4,8H2.
What are the key properties of N-[(2,4-dibromophenyl)methyl]cyclopentanamine?
N-[(2,4-dibromophenyl)methyl]cyclopentanamine has a molecular weight of 333.07 g/mol, XLogP of 4.24, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dibromophenyl)methyl]cyclopentanamine is sourced from PubChem (CID 107938680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).