6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine

C31H26N2 — CID 70884385

IUPAC6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine
SMILESCc1cc(-c2ccc3ccccc3n2)ccc1N1c2ccccc2-c2ccccc2C1(C)C
InChIInChI=1S/C31H26N2/c1-21-20-23(28-18-16-22-10-4-8-14-27(22)32-28)17-19-29(21)33-30-15-9-6-12-25(30)24-11-5-7-13-26(24)31(33,2)3/h4-20H,1-3H3
InChIKeyCYDKQPMZLULHAI-UHFFFAOYSA-N
MW426.56 g/mol
LogP8.26
Rot. Bonds2

About 6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine

6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine (PubChem CID 70884385) has the molecular formula C31H26N2 and a molecular weight of 426.56 g/mol. Its IUPAC name is 6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine.

Molecular Properties

Compound Name6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine
PubChem CID70884385
Molecular FormulaC31H26N2
Molecular Weight426.56 g/mol
Exact Mass426.21
IUPAC Name6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine
SMILESCc1cc(-c2ccc3ccccc3n2)ccc1N1c2ccccc2-c2ccccc2C1(C)C
InChIInChI=1S/C31H26N2/c1-21-20-23(28-18-16-22-10-4-8-14-27(22)32-28)17-19-29(21)33-30-15-9-6-12-25(30)24-11-5-7-13-26(24)31(33,2)3/h4-20H,1-3H3
InChIKeyCYDKQPMZLULHAI-UHFFFAOYSA-N
XLogP8.26
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500426.56
LogP ≤ 58.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine 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

5,5-dimethyl-2-[3-methyl-4-(2-methyl-4-quinolin-2-ylphenyl)phenyl]indeno[1,2-b]pyridine
CID 59747274
2-(5,5-dimethylindeno[1,2-b]pyridin-2-yl)-5,5-dimethyl-8-quinolin-2-ylindeno[1,2-b]pyridine
CID 59747284
13,13-dimethyl-5,10-di(quinolin-2-yl)-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene
CID 70885595
2-(7-quinolin-2-ylnaphthalen-2-yl)quinoline
CID 176883836
2,6-bis(9,9-dimethylfluoren-2-yl)-4-(4-quinolin-2-ylphenyl)benzo[h]quinoline
CID 70958731
2-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)-6-phenylpyrimidin-2-yl]quinoline
CID 168797147
2-(9,9-dimethylfluoren-3-yl)-1,7-naphthyridine
CID 155623955
2-[4-quinolin-2-yl-6-(9,9'-spirobi[fluorene]-3-yl)-1,3,5-triazin-2-yl]quinoline
CID 142479205
2-(2,5-dimethylphenyl)quinoline
CID 1202732
2-[3-(2-phenylphenyl)phenyl]quinoline
CID 68954156
2-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]quinoline
CID 59195716
5,5-dimethyl-4-naphthalen-1-yl-10-phenyl-7-quinolin-2-ylbenzo[b][1,8]naphthyridine
CID 142352639

Frequently Asked Questions

What is the IUPAC name of 6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine?
The IUPAC name of 6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine (CID 70884385) is 6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine.
What is the SMILES notation for 6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine?
The canonical SMILES for 6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine is Cc1cc(-c2ccc3ccccc3n2)ccc1N1c2ccccc2-c2ccccc2C1(C)C.
What is the InChIKey of 6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine?
The InChIKey is CYDKQPMZLULHAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H26N2/c1-21-20-23(28-18-16-22-10-4-8-14-27(22)32-28)17-19-29(21)33-30-15-9-6-12-25(30)24-11-5-7-13-26(24)31(33,2)3/h4-20H,1-3H3.
What are the key properties of 6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine?
6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine has a molecular weight of 426.56 g/mol, XLogP of 8.26, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dimethyl-5-(2-methyl-4-quinolin-2-ylphenyl)phenanthridine is sourced from PubChem (CID 70884385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).