N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine

C14H16IN3 — CID 106554214

IUPACN-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine
SMILESIc1cccc(-n2ccnc2NC2CCCC2)c1
InChIInChI=1S/C14H16IN3/c15-11-4-3-7-13(10-11)18-9-8-16-14(18)17-12-5-1-2-6-12/h3-4,7-10,12H,1-2,5-6H2,(H,16,17)
InChIKeyKTPSSOTYCSMQJK-UHFFFAOYSA-N
MW353.21 g/mol
LogP3.83
Rot. Bonds3

About N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine

N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine (PubChem CID 106554214) has the molecular formula C14H16IN3 and a molecular weight of 353.21 g/mol. Its IUPAC name is N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine.

Molecular Properties

Compound NameN-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine
PubChem CID106554214
Molecular FormulaC14H16IN3
Molecular Weight353.21 g/mol
Exact Mass353.04
IUPAC NameN-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine
SMILESIc1cccc(-n2ccnc2NC2CCCC2)c1
InChIInChI=1S/C14H16IN3/c15-11-4-3-7-13(10-11)18-9-8-16-14(18)17-12-5-1-2-6-12/h3-4,7-10,12H,1-2,5-6H2,(H,16,17)
InChIKeyKTPSSOTYCSMQJK-UHFFFAOYSA-N
XLogP3.83
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.21
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze N-cyclopentyl-1-(3-iodophenyl)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

Related Compounds

N-cyclopentyl-1-(3-methylphenyl)imidazol-2-amine
CID 106560185
N-cycloheptyl-1-phenylimidazol-2-amine
CID 106561276
N-cyclopentyl-1-(3-ethylphenyl)imidazol-2-amine
CID 106559803
N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine
CID 106566737
N-cyclohexyl-1-(3-iodophenyl)-4-methylimidazol-2-amine
CID 106554243
N-cyclopentyl-1-(3,4-dimethylphenyl)imidazol-2-amine
CID 106560237
N-cyclopentyl-1-(3,5-dichlorophenyl)imidazol-2-amine
CID 106557230
1-(3-bromo-4-fluorophenyl)-N-cyclopentylimidazol-2-amine
CID 106581538
N-cyclohexyl-1-(3,4,5-trifluorophenyl)imidazol-2-amine
CID 106570813
N-(1-phenylimidazol-2-yl)piperidin-4-amine
CID 115044800
1-(2-chloro-5-iodophenyl)-N-cyclopropylimidazol-2-amine
CID 114261820
N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine
CID 106564117

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine?
The IUPAC name of N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine (CID 106554214) is N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine.
What is the SMILES notation for N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine?
The canonical SMILES for N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine is Ic1cccc(-n2ccnc2NC2CCCC2)c1.
What is the InChIKey of N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine?
The InChIKey is KTPSSOTYCSMQJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16IN3/c15-11-4-3-7-13(10-11)18-9-8-16-14(18)17-12-5-1-2-6-12/h3-4,7-10,12H,1-2,5-6H2,(H,16,17).
What are the key properties of N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine?
N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine has a molecular weight of 353.21 g/mol, XLogP of 3.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine is sourced from PubChem (CID 106554214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).