6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline

C14H17N3 — CID 82512894

IUPAC6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline
SMILESCc1cn(-c2ccc3c(c2)CCCN3)c(C)n1
InChIInChI=1S/C14H17N3/c1-10-9-17(11(2)16-10)13-5-6-14-12(8-13)4-3-7-15-14/h5-6,8-9,15H,3-4,7H2,1-2H3
InChIKeyFPGNATXNFWNBBG-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.85
Rot. Bonds1

About 6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline

6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline (PubChem CID 82512894) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline
PubChem CID82512894
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline
SMILESCc1cn(-c2ccc3c(c2)CCCN3)c(C)n1
InChIInChI=1S/C14H17N3/c1-10-9-17(11(2)16-10)13-5-6-14-12(8-13)4-3-7-15-14/h5-6,8-9,15H,3-4,7H2,1-2H3
InChIKeyFPGNATXNFWNBBG-UHFFFAOYSA-N
XLogP2.85
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline 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

5-(2,4-dimethylimidazol-1-yl)-2,3-dihydro-1H-indole
CID 82512522
6-(3-methylpyrazol-1-yl)-1,2,3,4-tetrahydroquinoline
CID 81224527
6-(4-methylpyrazol-1-yl)-1,2,3,4-tetrahydroquinoline
CID 81224912
6-(azepan-1-yl)-1,2,3,4-tetrahydroquinoline
CID 39247840
ethane;6-methyl-1,2,3,4-tetrahydroquinoline
CID 144598135
6-methyl-1,2,3,4-tetrahydroquinoline;molecular iodine
CID 159662716
6-(2,3,4,5,6-pentamethylphenyl)-1,2,3,4-tetrahydroquinoline
CID 63424137
6-[(2S)-2-ethylpiperidin-1-yl]-1,2,3,4-tetrahydroquinoline
CID 97030516
6-indazol-1-yl-1,2,3,4-tetrahydroquinoline
CID 81224217
6-methyl-1-(1,2,3,4-tetrahydroquinolin-6-yl)-3,4-dihydro-2H-quinoline
CID 81217990
7-piperazin-1-yl-2,3,4,5-tetrahydro-1H-1-benzazepine
CID 83853200
2,5-dimethyl-4-(1,2,3,4-tetrahydroquinolin-6-yl)morpholine
CID 81214490

Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline (CID 82512894) is 6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline is Cc1cn(-c2ccc3c(c2)CCCN3)c(C)n1.
What is the InChIKey of 6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline?
The InChIKey is FPGNATXNFWNBBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-10-9-17(11(2)16-10)13-5-6-14-12(8-13)4-3-7-15-14/h5-6,8-9,15H,3-4,7H2,1-2H3.
What are the key properties of 6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline?
6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline has a molecular weight of 227.31 g/mol, XLogP of 2.85, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-dimethylimidazol-1-yl)-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 82512894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).