(2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone

C24H27N3O2 — CID 11682549

IUPAC(2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone
SMILESCc1nc2c3c(c(C(=O)N4CCOCC4)cn2c1C)CCC(c1ccccc1)C3
InChIInChI=1S/C24H27N3O2/c1-16-17(2)27-15-22(24(28)26-10-12-29-13-11-26)20-9-8-19(14-21(20)23(27)25-16)18-6-4-3-5-7-18/h3-7,15,19H,8-14H2,1-2H3
InChIKeyXDTJZTXSODFRQV-UHFFFAOYSA-N
MW389.50 g/mol
LogP3.70
Rot. Bonds2

About (2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone

(2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone (PubChem CID 11682549) has the molecular formula C24H27N3O2 and a molecular weight of 389.50 g/mol. Its IUPAC name is (2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone
PubChem CID11682549
Molecular FormulaC24H27N3O2
Molecular Weight389.50 g/mol
Exact Mass389.21
IUPAC Name(2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone
SMILESCc1nc2c3c(c(C(=O)N4CCOCC4)cn2c1C)CCC(c1ccccc1)C3
InChIInChI=1S/C24H27N3O2/c1-16-17(2)27-15-22(24(28)26-10-12-29-13-11-26)20-9-8-19(14-21(20)23(27)25-16)18-6-4-3-5-7-18/h3-7,15,19H,8-14H2,1-2H3
InChIKeyXDTJZTXSODFRQV-UHFFFAOYSA-N
XLogP3.70
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.50
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone 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 (2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone?
The IUPAC name of (2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone (CID 11682549) is (2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone is Cc1nc2c3c(c(C(=O)N4CCOCC4)cn2c1C)CCC(c1ccccc1)C3.
What is the InChIKey of (2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone?
The InChIKey is XDTJZTXSODFRQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O2/c1-16-17(2)27-15-22(24(28)26-10-12-29-13-11-26)20-9-8-19(14-21(20)23(27)25-16)18-6-4-3-5-7-18/h3-7,15,19H,8-14H2,1-2H3.
What are the key properties of (2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone?
(2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone has a molecular weight of 389.50 g/mol, XLogP of 3.70, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinolin-6-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 11682549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).