N-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine

C16H20FN3 — CID 106562507

IUPACN-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine
SMILESFc1cccc(CCn2ccnc2NC2CCCC2)c1
InChIInChI=1S/C16H20FN3/c17-14-5-3-4-13(12-14)8-10-20-11-9-18-16(20)19-15-6-1-2-7-15/h3-5,9,11-12,15H,1-2,6-8,10H2,(H,18,19)
InChIKeyQHUTXFZTWDJFIG-UHFFFAOYSA-N
MW273.35 g/mol
LogP3.62
Rot. Bonds5

About N-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine

N-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine (PubChem CID 106562507) has the molecular formula C16H20FN3 and a molecular weight of 273.35 g/mol. Its IUPAC name is N-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine.

Molecular Properties

Compound NameN-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine
PubChem CID106562507
Molecular FormulaC16H20FN3
Molecular Weight273.35 g/mol
Exact Mass273.16
IUPAC NameN-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine
SMILESFc1cccc(CCn2ccnc2NC2CCCC2)c1
InChIInChI=1S/C16H20FN3/c17-14-5-3-4-13(12-14)8-10-20-11-9-18-16(20)19-15-6-1-2-7-15/h3-5,9,11-12,15H,1-2,6-8,10H2,(H,18,19)
InChIKeyQHUTXFZTWDJFIG-UHFFFAOYSA-N
XLogP3.62
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.35
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine?
The IUPAC name of N-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine (CID 106562507) is N-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine.
What is the SMILES notation for N-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine?
The canonical SMILES for N-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine is Fc1cccc(CCn2ccnc2NC2CCCC2)c1.
What is the InChIKey of N-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine?
The InChIKey is QHUTXFZTWDJFIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN3/c17-14-5-3-4-13(12-14)8-10-20-11-9-18-16(20)19-15-6-1-2-7-15/h3-5,9,11-12,15H,1-2,6-8,10H2,(H,18,19).
What are the key properties of N-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine?
N-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine has a molecular weight of 273.35 g/mol, XLogP of 3.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-[2-(3-fluorophenyl)ethyl]imidazol-2-amine is sourced from PubChem (CID 106562507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).