2,4-dimethyl-5,6,7,8-tetrahydroquinoline

C11H15N — CID 5321849

IUPAC2,4-dimethyl-5,6,7,8-tetrahydroquinoline
SMILESCc1cc(C)c2c(n1)CCCC2
InChIInChI=1S/C11H15N/c1-8-7-9(2)12-11-6-4-3-5-10(8)11/h7H,3-6H2,1-2H3
InChIKeyZBIKAJHAGKBFKR-UHFFFAOYSA-N
MW161.25 g/mol
LogP2.58
Rot. Bonds

About 2,4-dimethyl-5,6,7,8-tetrahydroquinoline

2,4-dimethyl-5,6,7,8-tetrahydroquinoline (PubChem CID 5321849) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is 2,4-dimethyl-5,6,7,8-tetrahydroquinoline.

Molecular Properties

Compound Name2,4-dimethyl-5,6,7,8-tetrahydroquinoline
PubChem CID5321849
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Name2,4-dimethyl-5,6,7,8-tetrahydroquinoline
SMILESCc1cc(C)c2c(n1)CCCC2
InChIInChI=1S/C11H15N/c1-8-7-9(2)12-11-6-4-3-5-10(8)11/h7H,3-6H2,1-2H3
InChIKeyZBIKAJHAGKBFKR-UHFFFAOYSA-N
XLogP2.58
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2,4-dimethyl-5,6,7,8-tetrahydroquinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-5,6,7,8-tetrahydroquinoline?
The IUPAC name of 2,4-dimethyl-5,6,7,8-tetrahydroquinoline (CID 5321849) is 2,4-dimethyl-5,6,7,8-tetrahydroquinoline.
What is the SMILES notation for 2,4-dimethyl-5,6,7,8-tetrahydroquinoline?
The canonical SMILES for 2,4-dimethyl-5,6,7,8-tetrahydroquinoline is Cc1cc(C)c2c(n1)CCCC2.
What is the InChIKey of 2,4-dimethyl-5,6,7,8-tetrahydroquinoline?
The InChIKey is ZBIKAJHAGKBFKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N/c1-8-7-9(2)12-11-6-4-3-5-10(8)11/h7H,3-6H2,1-2H3.
What are the key properties of 2,4-dimethyl-5,6,7,8-tetrahydroquinoline?
2,4-dimethyl-5,6,7,8-tetrahydroquinoline has a molecular weight of 161.25 g/mol, XLogP of 2.58, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-5,6,7,8-tetrahydroquinoline is sourced from PubChem (CID 5321849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).