4-tert-butyl-2,6-dimethylquinoline

C15H19N — CID 20728117

IUPAC4-tert-butyl-2,6-dimethylquinoline
SMILESCc1ccc2nc(C)cc(C(C)(C)C)c2c1
InChIInChI=1S/C15H19N/c1-10-6-7-14-12(8-10)13(15(3,4)5)9-11(2)16-14/h6-9H,1-5H3
InChIKeyGOMVYQBQDZBQJN-UHFFFAOYSA-N
MW213.32 g/mol
LogP4.15
Rot. Bonds

About 4-tert-butyl-2,6-dimethylquinoline

4-tert-butyl-2,6-dimethylquinoline (PubChem CID 20728117) has the molecular formula C15H19N and a molecular weight of 213.32 g/mol. Its IUPAC name is 4-tert-butyl-2,6-dimethylquinoline.

Molecular Properties

Compound Name4-tert-butyl-2,6-dimethylquinoline
PubChem CID20728117
Molecular FormulaC15H19N
Molecular Weight213.32 g/mol
Exact Mass213.15
IUPAC Name4-tert-butyl-2,6-dimethylquinoline
SMILESCc1ccc2nc(C)cc(C(C)(C)C)c2c1
InChIInChI=1S/C15H19N/c1-10-6-7-14-12(8-10)13(15(3,4)5)9-11(2)16-14/h6-9H,1-5H3
InChIKeyGOMVYQBQDZBQJN-UHFFFAOYSA-N
XLogP4.15
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-tert-butyl-2,6-dimethylquinoline 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-ethyl-2,6-dimethylquinolin-4-amine
CID 62201642
2-tert-butyl-6-methylquinolin-4-amine
CID 62202003
9-tert-butyl-2,3,7-trimethylacridine
CID 157493944
6-bromo-2,4-ditert-butylquinoline
CID 153459061
N'-(2,6-dimethylquinolin-4-yl)ethane-1,2-diamine
CID 3132199
2-(6-ethyl-2-methylquinolin-4-yl)propan-2-amine
CID 82448244
2-(6-methoxy-2-methylquinolin-4-yl)propan-2-ol
CID 82449762
N-(4-iodophenyl)-2,6-dimethylquinolin-4-amine
CID 1184486
N-benzyl-2,6-dimethylquinolin-4-amine
CID 719873
9-tert-butyl-1,4,7-trimethylacridine
CID 159196230
2,6-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline
CID 170985199
2-(2,6-dimethylquinolin-4-yl)acetamide
CID 82575379

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-2,6-dimethylquinoline?
The IUPAC name of 4-tert-butyl-2,6-dimethylquinoline (CID 20728117) is 4-tert-butyl-2,6-dimethylquinoline.
What is the SMILES notation for 4-tert-butyl-2,6-dimethylquinoline?
The canonical SMILES for 4-tert-butyl-2,6-dimethylquinoline is Cc1ccc2nc(C)cc(C(C)(C)C)c2c1.
What is the InChIKey of 4-tert-butyl-2,6-dimethylquinoline?
The InChIKey is GOMVYQBQDZBQJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N/c1-10-6-7-14-12(8-10)13(15(3,4)5)9-11(2)16-14/h6-9H,1-5H3.
What are the key properties of 4-tert-butyl-2,6-dimethylquinoline?
4-tert-butyl-2,6-dimethylquinoline has a molecular weight of 213.32 g/mol, XLogP of 4.15, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-2,6-dimethylquinoline is sourced from PubChem (CID 20728117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).