N-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine

C17H20N4 — CID 133376584

IUPACN-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine
SMILESCc1cc(N(C)CCCn2ccnc2)c2ccccc2n1
InChIInChI=1S/C17H20N4/c1-14-12-17(15-6-3-4-7-16(15)19-14)20(2)9-5-10-21-11-8-18-13-21/h3-4,6-8,11-13H,5,9-10H2,1-2H3
InChIKeyOOOMSVKNOFCFMV-UHFFFAOYSA-N
MW280.38 g/mol
LogP3.27
Rot. Bonds5

About N-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine

N-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine (PubChem CID 133376584) has the molecular formula C17H20N4 and a molecular weight of 280.38 g/mol. Its IUPAC name is N-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine.

Molecular Properties

Compound NameN-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine
PubChem CID133376584
Molecular FormulaC17H20N4
Molecular Weight280.38 g/mol
Exact Mass280.17
IUPAC NameN-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine
SMILESCc1cc(N(C)CCCn2ccnc2)c2ccccc2n1
InChIInChI=1S/C17H20N4/c1-14-12-17(15-6-3-4-7-16(15)19-14)20(2)9-5-10-21-11-8-18-13-21/h3-4,6-8,11-13H,5,9-10H2,1-2H3
InChIKeyOOOMSVKNOFCFMV-UHFFFAOYSA-N
XLogP3.27
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.38
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-(3-imidazol-1-ylpropyl)-N,2-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

8-fluoro-N-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine
CID 133376570
2-[methyl-(2-methylquinolin-4-yl)amino]ethanol
CID 60716400
N-(3-imidazol-1-ylpropyl)-N,4-dimethylpyrimidin-2-amine
CID 133376553
1-imidazol-1-yl-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine
CID 78943044
1-[methyl-(2-methylquinolin-4-yl)amino]propan-2-ol
CID 55060878
N-[(2-aminophenyl)methyl]-N,2-dimethylquinolin-4-amine
CID 60871553
4-chloro-2-N-(3-imidazol-1-ylpropyl)-2-N-methylbenzene-1,2-diamine
CID 107466060
6,8-difluoro-N-(3-imidazol-1-ylpropyl)-N-methylquinolin-4-amine
CID 133494736
N-(3-imidazol-1-ylpropyl)-N-methyl-5-nitroquinolin-8-amine
CID 133376544
N',2,2-trimethyl-N'-(2-methylquinolin-4-yl)propane-1,3-diamine
CID 79660068
3-bromo-N-(3-imidazol-1-ylpropyl)-N,5-dimethylpyridin-2-amine
CID 99841114
6-ethyl-N-(3-imidazol-1-ylpropyl)-N,2-dimethylpyrimidin-4-amine
CID 133472744

Frequently Asked Questions

What is the IUPAC name of N-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine?
The IUPAC name of N-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine (CID 133376584) is N-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine.
What is the SMILES notation for N-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine?
The canonical SMILES for N-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine is Cc1cc(N(C)CCCn2ccnc2)c2ccccc2n1.
What is the InChIKey of N-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine?
The InChIKey is OOOMSVKNOFCFMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4/c1-14-12-17(15-6-3-4-7-16(15)19-14)20(2)9-5-10-21-11-8-18-13-21/h3-4,6-8,11-13H,5,9-10H2,1-2H3.
What are the key properties of N-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine?
N-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine has a molecular weight of 280.38 g/mol, XLogP of 3.27, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-imidazol-1-ylpropyl)-N,2-dimethylquinolin-4-amine is sourced from PubChem (CID 133376584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).