5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine

C31H23N — CID 169291706

IUPAC5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine
SMILES[2H]C([2H])([2H])c1cccc2c1C(c1ccccc1)c1cc(-c3cccc(-c4ccccc4)c3)ncc1-2
InChIInChI=1S/C31H23N/c1-21-10-8-17-26-28-20-32-29(19-27(28)31(30(21)26)23-13-6-3-7-14-23)25-16-9-15-24(18-25)22-11-4-2-5-12-22/h2-20,31H,1H3/i1D3
InChIKeyZMSVKMZZFDAMRH-FIBGUPNXSA-N
MW412.55 g/mol
LogP7.88
Rot. Bonds4

About 5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine

5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine (PubChem CID 169291706) has the molecular formula C31H23N and a molecular weight of 412.55 g/mol. Its IUPAC name is 5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine.

Molecular Properties

Compound Name5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine
PubChem CID169291706
Molecular FormulaC31H23N
Molecular Weight412.55 g/mol
Exact Mass412.20
IUPAC Name5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine
SMILES[2H]C([2H])([2H])c1cccc2c1C(c1ccccc1)c1cc(-c3cccc(-c4ccccc4)c3)ncc1-2
InChIInChI=1S/C31H23N/c1-21-10-8-17-26-28-20-32-29(19-27(28)31(30(21)26)23-13-6-3-7-14-23)25-16-9-15-24(18-25)22-11-4-2-5-12-22/h2-20,31H,1H3/i1D3
InChIKeyZMSVKMZZFDAMRH-FIBGUPNXSA-N
XLogP7.88
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500412.55
LogP ≤ 57.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine 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-phenyl-5-[2-[3-[2-[6-[3-(3-phenylphenyl)phenyl]-4-(trideuteriomethyl)-3-pyridinyl]phenyl]-5-[2-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-(trideuteriomethyl)pyridine
CID 153458053
5-[2-[3,5-bis[2-[4-methyl-6-[3-(3-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-4-methyl-2-[3-(3-phenylphenyl)phenyl]pyridine
CID 140838981
5-methyl-4-phenyl-2-(3-phenylphenyl)pyridine
CID 140676048
5-(trideuteriomethyl)-2-[3-[2-(trideuteriomethyl)phenyl]phenyl]pyridine
CID 166502915
4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine
CID 159742768
2-phenyl-5-[2-(trideuteriomethyl)phenyl]pyridine
CID 59546973
2-[4-[2-[3,5-bis[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-5-phenyl-4-(trideuteriomethyl)pyridine
CID 140838393
1-methyl-2-phenyl-3-(3-phenylphenyl)benzene
CID 59171668
trimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane
CID 140710280
2-phenyl-5-[2-[3-[2-[6-(3-phenylphenyl)-3-pyridinyl]phenyl]-5-[2-(6-phenyl-3-pyridinyl)phenyl]phenyl]phenyl]pyridine
CID 134191385
methane;4-methyl-5-(2-methylphenyl)-2-phenylpyridine
CID 142322015
2-(2-methylphenyl)-3-phenyl-5-(3-phenylphenyl)pyrazine
CID 118267385

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine?
The IUPAC name of 5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine (CID 169291706) is 5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine.
What is the SMILES notation for 5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine?
The canonical SMILES for 5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine is [2H]C([2H])([2H])c1cccc2c1C(c1ccccc1)c1cc(-c3cccc(-c4ccccc4)c3)ncc1-2.
What is the InChIKey of 5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine?
The InChIKey is ZMSVKMZZFDAMRH-FIBGUPNXSA-N. The full InChI is InChI=1S/C31H23N/c1-21-10-8-17-26-28-20-32-29(19-27(28)31(30(21)26)23-13-6-3-7-14-23)25-16-9-15-24(18-25)22-11-4-2-5-12-22/h2-20,31H,1H3/i1D3.
What are the key properties of 5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine?
5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine has a molecular weight of 412.55 g/mol, XLogP of 7.88, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-3-(3-phenylphenyl)-6-(trideuteriomethyl)-5H-indeno[1,2-c]pyridine is sourced from PubChem (CID 169291706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).