N-(4-iodophenyl)-2,6-dimethylquinolin-4-amine

C17H15IN2 — CID 1184486

IUPACN-(4-iodophenyl)-2,6-dimethylquinolin-4-amine
SMILESCc1ccc2nc(C)cc(Nc3ccc(I)cc3)c2c1
InChIInChI=1S/C17H15IN2/c1-11-3-8-16-15(9-11)17(10-12(2)19-16)20-14-6-4-13(18)5-7-14/h3-10H,1-2H3,(H,19,20)
InChIKeyKDLSKZHSYJGDRO-UHFFFAOYSA-N
MW374.23 g/mol
LogP5.20
Rot. Bonds2

About N-(4-iodophenyl)-2,6-dimethylquinolin-4-amine

N-(4-iodophenyl)-2,6-dimethylquinolin-4-amine (PubChem CID 1184486) has the molecular formula C17H15IN2 and a molecular weight of 374.23 g/mol. Its IUPAC name is N-(4-iodophenyl)-2,6-dimethylquinolin-4-amine.

Molecular Properties

Compound NameN-(4-iodophenyl)-2,6-dimethylquinolin-4-amine
PubChem CID1184486
Molecular FormulaC17H15IN2
Molecular Weight374.23 g/mol
Exact Mass374.03
IUPAC NameN-(4-iodophenyl)-2,6-dimethylquinolin-4-amine
SMILESCc1ccc2nc(C)cc(Nc3ccc(I)cc3)c2c1
InChIInChI=1S/C17H15IN2/c1-11-3-8-16-15(9-11)17(10-12(2)19-16)20-14-6-4-13(18)5-7-14/h3-10H,1-2H3,(H,19,20)
InChIKeyKDLSKZHSYJGDRO-UHFFFAOYSA-N
XLogP5.20
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.23
LogP ≤ 55.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(4-iodophenyl)-2,6-dimethylquinolin-4-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

2-methyl-4-N-(4-methylphenyl)quinoline-4,6-diamine
CID 22417903
6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine
CID 730830
N-[4-[4-[(2,6-dimethylquinolin-4-yl)amino]phenyl]sulfonylphenyl]acetamide
CID 146541441
N-ethyl-2,6-dimethylquinolin-4-amine
CID 62201642
methyl 3-[(2,6-dimethylquinolin-4-yl)amino]benzoate;hydrochloride
CID 2789796
4-[(2-methylquinolin-4-yl)amino]phenol
CID 939157
6-chloro-N-(3,4-dichlorophenyl)-2-methylquinolin-4-amine
CID 730833
4-(2,4-dimethylanilino)-2-methylquinoline-6-carboxylic acid
CID 7719183
4-[(6-hydroxy-2-methylquinolin-4-yl)amino]benzoic acid;hydrochloride
CID 16876467
N-(4-fluorophenyl)-6-methoxy-2-methylquinolin-4-amine
CID 798853
N'-(2,6-dimethylquinolin-4-yl)ethane-1,2-diamine
CID 3132199
6-methoxy-2-methyl-N-(4-propan-2-yloxyphenyl)quinolin-4-amine
CID 110435675

Frequently Asked Questions

What is the IUPAC name of N-(4-iodophenyl)-2,6-dimethylquinolin-4-amine?
The IUPAC name of N-(4-iodophenyl)-2,6-dimethylquinolin-4-amine (CID 1184486) is N-(4-iodophenyl)-2,6-dimethylquinolin-4-amine.
What is the SMILES notation for N-(4-iodophenyl)-2,6-dimethylquinolin-4-amine?
The canonical SMILES for N-(4-iodophenyl)-2,6-dimethylquinolin-4-amine is Cc1ccc2nc(C)cc(Nc3ccc(I)cc3)c2c1.
What is the InChIKey of N-(4-iodophenyl)-2,6-dimethylquinolin-4-amine?
The InChIKey is KDLSKZHSYJGDRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15IN2/c1-11-3-8-16-15(9-11)17(10-12(2)19-16)20-14-6-4-13(18)5-7-14/h3-10H,1-2H3,(H,19,20).
What are the key properties of N-(4-iodophenyl)-2,6-dimethylquinolin-4-amine?
N-(4-iodophenyl)-2,6-dimethylquinolin-4-amine has a molecular weight of 374.23 g/mol, XLogP of 5.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-iodophenyl)-2,6-dimethylquinolin-4-amine is sourced from PubChem (CID 1184486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).