N-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine

C11H14BrN — CID 30110346

IUPACN-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine
SMILESC[C@@H](NC1CC1)c1ccc(Br)cc1
InChIInChI=1S/C11H14BrN/c1-8(13-11-6-7-11)9-2-4-10(12)5-3-9/h2-5,8,11,13H,6-7H2,1H3/t8-/m1/s1
InChIKeyTXBVIKNBHAWCLX-MRVPVSSYSA-N
MW240.14 g/mol
LogP3.26
Rot. Bonds3

About N-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine

N-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine (PubChem CID 30110346) has the molecular formula C11H14BrN and a molecular weight of 240.14 g/mol. Its IUPAC name is N-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine
PubChem CID30110346
Molecular FormulaC11H14BrN
Molecular Weight240.14 g/mol
Exact Mass239.03
IUPAC NameN-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine
SMILESC[C@@H](NC1CC1)c1ccc(Br)cc1
InChIInChI=1S/C11H14BrN/c1-8(13-11-6-7-11)9-2-4-10(12)5-3-9/h2-5,8,11,13H,6-7H2,1H3/t8-/m1/s1
InChIKeyTXBVIKNBHAWCLX-MRVPVSSYSA-N
XLogP3.26
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.14
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine 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-[1-(4-bromophenyl)ethyl]-4-methylcyclohexan-1-amine
CID 43080674
N-[(1S)-1-(4-bromophenyl)ethyl]oxan-4-amine
CID 81354361
N-[(1S)-1-(4-bromophenyl)ethyl]thian-4-amine
CID 81359779
N-[1-(4-bromophenyl)ethyl]-4-(trifluoromethyl)cyclohexan-1-amine
CID 43730386
N-[(1R)-1-(4-bromophenyl)ethyl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
CID 81353587
N-[(1S)-1-(4-bromophenyl)ethyl]-4-tert-butylcycloheptan-1-amine
CID 81356835
N-[(1S)-1-(4-bromophenyl)ethyl]-4,4-dimethylcycloheptan-1-amine
CID 81354248
N-[1-(4-bromophenyl)ethyl]-3,5-dimethylcyclohexan-1-amine
CID 64753603
N-[1-(4-methylphenyl)ethyl]cyclopropanamine
CID 16771025
N-[1-(4-bromophenyl)-2-methylpropyl]cyclopropanamine
CID 83693837
3-(4-bromophenyl)-N-[(1S)-1-(4-bromophenyl)ethyl]cyclobutan-1-amine
CID 81356335
N-[1-(4-bromophenyl)ethyl]-3-methylcyclohexan-1-amine
CID 43215999

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine?
The IUPAC name of N-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine (CID 30110346) is N-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine.
What is the SMILES notation for N-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine?
The canonical SMILES for N-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine is C[C@@H](NC1CC1)c1ccc(Br)cc1.
What is the InChIKey of N-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine?
The InChIKey is TXBVIKNBHAWCLX-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H14BrN/c1-8(13-11-6-7-11)9-2-4-10(12)5-3-9/h2-5,8,11,13H,6-7H2,1H3/t8-/m1/s1.
What are the key properties of N-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine?
N-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine has a molecular weight of 240.14 g/mol, XLogP of 3.26, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(4-bromophenyl)ethyl]cyclopropanamine is sourced from PubChem (CID 30110346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).