4-methyl-2,6-dihydroisoquinoline

C10H11N — CID 21059285

IUPAC4-methyl-2,6-dihydroisoquinoline
SMILESCC1=CNC=C2C=CCC=C12
InChIInChI=1S/C10H11N/c1-8-6-11-7-9-4-2-3-5-10(8)9/h2,4-7,11H,3H2,1H3
InChIKeyOVSFVBGHHIGNDJ-UHFFFAOYSA-N
MW145.20 g/mol
LogP2.26
Rot. Bonds

About 4-methyl-2,6-dihydroisoquinoline

4-methyl-2,6-dihydroisoquinoline (PubChem CID 21059285) has the molecular formula C10H11N and a molecular weight of 145.20 g/mol. Its IUPAC name is 4-methyl-2,6-dihydroisoquinoline.

Molecular Properties

Compound Name4-methyl-2,6-dihydroisoquinoline
PubChem CID21059285
Molecular FormulaC10H11N
Molecular Weight145.20 g/mol
Exact Mass145.09
IUPAC Name4-methyl-2,6-dihydroisoquinoline
SMILESCC1=CNC=C2C=CCC=C12
InChIInChI=1S/C10H11N/c1-8-6-11-7-9-4-2-3-5-10(8)9/h2,4-7,11H,3H2,1H3
InChIKeyOVSFVBGHHIGNDJ-UHFFFAOYSA-N
XLogP2.26
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-methyl-2,6-dihydroisoquinoline 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-(4-methylphenyl)cyclohepta-1,3,5-triene
CID 142804682
dimethyl-(2-methyl-3aH-inden-1-yl)-(2-methyl-6H-inden-1-yl)silane
CID 18717169
1-cyclopenta-1,4-dien-1-yl-2,3,4-trimethylcyclopenta-1,3-diene
CID 19977693
1-tert-butyl-4-cyclopenta-1,4-dien-1-ylbenzene
CID 19103892
3,4-dichloro-2-methylcyclohepta-1,3,5-triene
CID 142429780
4-bromo-2-methylcyclohepta-1,3,5-triene
CID 143463506
2-cyclopenta-1,4-dien-1-yl-4-methyl-1,3-thiazole;methoxymethane
CID 142254692
1-cyclopenta-1,4-dien-1-yl-2,3,4,5,5-pentamethylcyclopenta-1,3-diene
CID 21226322
2-prop-1-en-2-yl-5H-indene
CID 135556108
1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene
CID 147554829
1,7-dihydroquinazoline
CID 142336195
ethane;3-ethyl-2,4-dimethylcyclohepta-1,3,5-triene
CID 145320369

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2,6-dihydroisoquinoline?
The IUPAC name of 4-methyl-2,6-dihydroisoquinoline (CID 21059285) is 4-methyl-2,6-dihydroisoquinoline.
What is the SMILES notation for 4-methyl-2,6-dihydroisoquinoline?
The canonical SMILES for 4-methyl-2,6-dihydroisoquinoline is CC1=CNC=C2C=CCC=C12.
What is the InChIKey of 4-methyl-2,6-dihydroisoquinoline?
The InChIKey is OVSFVBGHHIGNDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N/c1-8-6-11-7-9-4-2-3-5-10(8)9/h2,4-7,11H,3H2,1H3.
What are the key properties of 4-methyl-2,6-dihydroisoquinoline?
4-methyl-2,6-dihydroisoquinoline has a molecular weight of 145.20 g/mol, XLogP of 2.26, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2,6-dihydroisoquinoline is sourced from PubChem (CID 21059285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).