2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine

C16H20BrN3 — CID 106738477

IUPAC2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine
SMILESNCC(C1CCCC1)n1cncc1-c1cccc(Br)c1
InChIInChI=1S/C16H20BrN3/c17-14-7-3-6-13(8-14)16-10-19-11-20(16)15(9-18)12-4-1-2-5-12/h3,6-8,10-12,15H,1-2,4-5,9,18H2
InChIKeyWKCWSZYLRSHXHR-UHFFFAOYSA-N
MW334.26 g/mol
LogP4.00
Rot. Bonds4

About 2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine

2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine (PubChem CID 106738477) has the molecular formula C16H20BrN3 and a molecular weight of 334.26 g/mol. Its IUPAC name is 2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine.

Molecular Properties

Compound Name2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine
PubChem CID106738477
Molecular FormulaC16H20BrN3
Molecular Weight334.26 g/mol
Exact Mass333.08
IUPAC Name2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine
SMILESNCC(C1CCCC1)n1cncc1-c1cccc(Br)c1
InChIInChI=1S/C16H20BrN3/c17-14-7-3-6-13(8-14)16-10-19-11-20(16)15(9-18)12-4-1-2-5-12/h3,6-8,10-12,15H,1-2,4-5,9,18H2
InChIKeyWKCWSZYLRSHXHR-UHFFFAOYSA-N
XLogP4.00
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.26
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine 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

2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine
CID 106738459
2-cyclopentyl-2-(5-pentan-3-ylimidazol-1-yl)ethanamine
CID 106738456
4-[5-(3-bromophenyl)imidazol-1-yl]piperidine
CID 84739493
2-(5-tert-butylimidazol-1-yl)-2-cyclopentylethanamine
CID 106738472
3-[3-(1-cyclohexylpropyl)imidazol-4-yl]pyridin-4-amine
CID 114720144
2-(3-bromophenyl)sulfanyl-2-cyclopentylethanamine
CID 82931960
5-(3-bromophenyl)-2-cyclopropyl-1H-imidazole
CID 89481039
4-[5-(3-bromophenyl)-1H-imidazol-2-yl]piperidine
CID 43650774
3-[5-(3-bromophenyl)-1H-imidazol-2-yl]piperidine
CID 43651037
(S)-(3-bromophenyl)-cyclohexylmethanamine
CID 93312550
5-(3-bromophenyl)-1,3-dimethylpyrazole
CID 116856814
3-[5-(3-bromophenyl)-1H-imidazol-2-yl]cyclohexan-1-amine
CID 63046992

Frequently Asked Questions

What is the IUPAC name of 2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine?
The IUPAC name of 2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine (CID 106738477) is 2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine.
What is the SMILES notation for 2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine?
The canonical SMILES for 2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine is NCC(C1CCCC1)n1cncc1-c1cccc(Br)c1.
What is the InChIKey of 2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine?
The InChIKey is WKCWSZYLRSHXHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20BrN3/c17-14-7-3-6-13(8-14)16-10-19-11-20(16)15(9-18)12-4-1-2-5-12/h3,6-8,10-12,15H,1-2,4-5,9,18H2.
What are the key properties of 2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine?
2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine has a molecular weight of 334.26 g/mol, XLogP of 4.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(3-bromophenyl)imidazol-1-yl]-2-cyclopentylethanamine is sourced from PubChem (CID 106738477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).