3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline

C21H23N3 — CID 135306256

IUPAC3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline
SMILESCc1cccn2c(C3=NC(C)(C)C(C)(C)c4ccccc43)cnc12
InChIInChI=1S/C21H23N3/c1-14-9-8-12-24-17(13-22-19(14)24)18-15-10-6-7-11-16(15)20(2,3)21(4,5)23-18/h6-13H,1-5H3
InChIKeySJGXKFZWLKJCMY-UHFFFAOYSA-N
MW317.44 g/mol
LogP4.55
Rot. Bonds1

About 3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline

3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline (PubChem CID 135306256) has the molecular formula C21H23N3 and a molecular weight of 317.44 g/mol. Its IUPAC name is 3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline.

Molecular Properties

Compound Name3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline
PubChem CID135306256
Molecular FormulaC21H23N3
Molecular Weight317.44 g/mol
Exact Mass317.19
IUPAC Name3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline
SMILESCc1cccn2c(C3=NC(C)(C)C(C)(C)c4ccccc43)cnc12
InChIInChI=1S/C21H23N3/c1-14-9-8-12-24-17(13-22-19(14)24)18-15-10-6-7-11-16(15)20(2,3)21(4,5)23-18/h6-13H,1-5H3
InChIKeySJGXKFZWLKJCMY-UHFFFAOYSA-N
XLogP4.55
TPSA29.66 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.44
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline 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

1-(7,8-dichloroimidazo[1,2-a]pyridin-3-yl)-4,4-difluoro-3,3-dimethylisoquinoline
CID 135306237
3-(5-fluoro-3,3,4,4-tetramethylisoquinolin-1-yl)imidazo[1,2-a]pyridine-8-carbonitrile
CID 135306228
7-fluoro-1-imidazo[1,2-a]pyridin-3-yl-3,3,4,4-tetramethylisoquinoline
CID 135306264
5-fluoro-1-imidazo[1,2-a]pyridin-3-yl-3,3,4,4-tetramethylisoquinoline
CID 135306253
3,3,4,4-tetramethyl-1-(4-methylbenzimidazol-1-yl)isoquinoline
CID 134358940
5-fluoro-3,3,4,4-tetramethyl-1-(8-methylpyrrolo[1,2-a]pyrimidin-3-yl)isoquinoline
CID 123197246
2-(3,3,4,4-tetramethylisoquinolin-1-yl)thieno[2,3-b]pyrazine
CID 135152778
3-iodo-8-methylimidazo[1,2-a]pyridine
CID 115404343
2-(3,3,4,4-tetramethylisoquinolin-1-yl)-5,6,7,8-tetrahydroquinoxaline
CID 135152929
(8-methylimidazo[1,2-a]pyridin-3-yl)-pyridin-4-ylmethanamine
CID 82029116
3-(chloromethyl)-8-methylimidazo[1,2-a]pyridine
CID 10726071
3-(2-bromophenyl)-8-methylimidazo[1,5-a]pyridine
CID 117147172

Frequently Asked Questions

What is the IUPAC name of 3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline?
The IUPAC name of 3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline (CID 135306256) is 3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline.
What is the SMILES notation for 3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline?
The canonical SMILES for 3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline is Cc1cccn2c(C3=NC(C)(C)C(C)(C)c4ccccc43)cnc12.
What is the InChIKey of 3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline?
The InChIKey is SJGXKFZWLKJCMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3/c1-14-9-8-12-24-17(13-22-19(14)24)18-15-10-6-7-11-16(15)20(2,3)21(4,5)23-18/h6-13H,1-5H3.
What are the key properties of 3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline?
3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline has a molecular weight of 317.44 g/mol, XLogP of 4.55, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,4,4-tetramethyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)isoquinoline is sourced from PubChem (CID 135306256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).