7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole

C28H25N — CID 170390566

IUPAC7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole
SMILESCc1ccc(-n2c3ccccc3c3cc4c(cc32)C(C)(C)C2=C4C=CCC2)cc1
InChIInChI=1S/C28H25N/c1-18-12-14-19(15-13-18)29-26-11-7-5-9-21(26)23-16-22-20-8-4-6-10-24(20)28(2,3)25(22)17-27(23)29/h4-5,7-9,11-17H,6,10H2,1-3H3
InChIKeyALTKKXHUOVTAKU-UHFFFAOYSA-N
MW375.52 g/mol
LogP7.49
Rot. Bonds1

About 7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole

7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole (PubChem CID 170390566) has the molecular formula C28H25N and a molecular weight of 375.52 g/mol. Its IUPAC name is 7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole.

Molecular Properties

Compound Name7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole
PubChem CID170390566
Molecular FormulaC28H25N
Molecular Weight375.52 g/mol
Exact Mass375.20
IUPAC Name7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole
SMILESCc1ccc(-n2c3ccccc3c3cc4c(cc32)C(C)(C)C2=C4C=CCC2)cc1
InChIInChI=1S/C28H25N/c1-18-12-14-19(15-13-18)29-26-11-7-5-9-21(26)23-16-22-20-8-4-6-10-24(20)28(2,3)25(22)17-27(23)29/h4-5,7-9,11-17H,6,10H2,1-3H3
InChIKeyALTKKXHUOVTAKU-UHFFFAOYSA-N
XLogP7.49
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.52
LogP ≤ 57.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole 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

Frequently Asked Questions

What is the IUPAC name of 7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole?
The IUPAC name of 7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole (CID 170390566) is 7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole.
What is the SMILES notation for 7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole?
The canonical SMILES for 7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole is Cc1ccc(-n2c3ccccc3c3cc4c(cc32)C(C)(C)C2=C4C=CCC2)cc1.
What is the InChIKey of 7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole?
The InChIKey is ALTKKXHUOVTAKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H25N/c1-18-12-14-19(15-13-18)29-26-11-7-5-9-21(26)23-16-22-20-8-4-6-10-24(20)28(2,3)25(22)17-27(23)29/h4-5,7-9,11-17H,6,10H2,1-3H3.
What are the key properties of 7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole?
7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole has a molecular weight of 375.52 g/mol, XLogP of 7.49, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dimethyl-5-(4-methylphenyl)-8,9-dihydroindeno[2,1-b]carbazole is sourced from PubChem (CID 170390566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).