[9,9-dimethyl-10-[3-(3-methyl-2H-imidazol-1-yl)phenyl]acridin-3-yl]-dimethyl-pyridin-2-ylsilane

C32H34N4Si — CID 140717316

IUPAC[9,9-dimethyl-10-[3-(3-methyl-2H-imidazol-1-yl)phenyl]acridin-3-yl]-dimethyl-pyridin-2-ylsilane
SMILESCN1C=CN(c2cccc(N3c4ccccc4C(C)(C)c4ccc([Si](C)(C)c5ccccn5)cc43)c2)C1
InChIInChI=1S/C32H34N4Si/c1-32(2)27-13-6-7-14-29(27)36(25-12-10-11-24(21-25)35-20-19-34(3)23-35)30-22-26(16-17-28(30)32)37(4,5)31-15-8-9-18-33-31/h6-22H,23H2,1-5H3
InChIKeyVNUSGFDTUFLTAE-UHFFFAOYSA-N
MW502.74 g/mol
LogP6.19
Rot. Bonds4

About [9,9-dimethyl-10-[3-(3-methyl-2H-imidazol-1-yl)phenyl]acridin-3-yl]-dimethyl-pyridin-2-ylsilane

[9,9-dimethyl-10-[3-(3-methyl-2H-imidazol-1-yl)phenyl]acridin-3-yl]-dimethyl-pyridin-2-ylsilane (PubChem CID 140717316) has the molecular formula C32H34N4Si and a molecular weight of 502.74 g/mol. Its IUPAC name is [9,9-dimethyl-10-[3-(3-methyl-2H-imidazol-1-yl)phenyl]acridin-3-yl]-dimethyl-pyridin-2-ylsilane.

Molecular Properties

Compound Name[9,9-dimethyl-10-[3-(3-methyl-2H-imidazol-1-yl)phenyl]acridin-3-yl]-dimethyl-pyridin-2-ylsilane
PubChem CID140717316
Molecular FormulaC32H34N4Si
Molecular Weight502.74 g/mol
Exact Mass502.26
IUPAC Name[9,9-dimethyl-10-[3-(3-methyl-2H-imidazol-1-yl)phenyl]acridin-3-yl]-dimethyl-pyridin-2-ylsilane
SMILESCN1C=CN(c2cccc(N3c4ccccc4C(C)(C)c4ccc([Si](C)(C)c5ccccn5)cc43)c2)C1
InChIInChI=1S/C32H34N4Si/c1-32(2)27-13-6-7-14-29(27)36(25-12-10-11-24(21-25)35-20-19-34(3)23-35)30-22-26(16-17-28(30)32)37(4,5)31-15-8-9-18-33-31/h6-22H,23H2,1-5H3
InChIKeyVNUSGFDTUFLTAE-UHFFFAOYSA-N
XLogP6.19
TPSA22.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500502.74
LogP ≤ 56.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

9,9-dimethyl-10-[3-(3-methyl-2H-benzimidazol-1-yl)phenyl]-3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)acridine
CID 140717296
2-(3-methyl-2H-imidazol-1-yl)-11-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-5,6-dihydrobenzo[b][1]benzazepine
CID 140683337
5-[3-(4,6-dipyridin-2-ylpyrimidin-2-yl)phenyl]-12,12-dimethylbenzo[b]acridine
CID 163883087
1-(9,9-dimethylfluoren-2-yl)-3-methyl-2H-imidazole
CID 59348265
9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine
CID 118881708
3-(9,9-dimethyl-10-phenylacridin-3-yl)-9,9-dimethyl-10-phenylacridine
CID 58489784
10-[3-[3-(5,5-dimethylbenzo[b][1,8]naphthyridin-10-yl)phenoxy]phenyl]-5,5-dimethylbenzo[b][1,8]naphthyridine
CID 118553245
30,30-dimethyl-23-phenyl-3,23-diazaheptacyclo[18.12.0.02,7.08,13.014,19.022,31.024,29]dotriaconta-1(32),2(7),3,5,8,10,12,14,16,18,20,22(31),24,26,28-pentadecaene
CID 134428452
9,9-dimethyl-10-pyridin-2-ylacridin-3-ol
CID 118539200
9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine
CID 59399643
9,9-dimethyl-3-(5-methyl-1H-pyrazol-3-yl)-10-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)phenyl]acridine
CID 140716309
3-(9,9-dimethyl-10-phenylacridin-3-yl)-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)aniline
CID 121259013

Frequently Asked Questions

What is the IUPAC name of [9,9-dimethyl-10-[3-(3-methyl-2H-imidazol-1-yl)phenyl]acridin-3-yl]-dimethyl-pyridin-2-ylsilane?
The IUPAC name of [9,9-dimethyl-10-[3-(3-methyl-2H-imidazol-1-yl)phenyl]acridin-3-yl]-dimethyl-pyridin-2-ylsilane (CID 140717316) is [9,9-dimethyl-10-[3-(3-methyl-2H-imidazol-1-yl)phenyl]acridin-3-yl]-dimethyl-pyridin-2-ylsilane.
What is the SMILES notation for [9,9-dimethyl-10-[3-(3-methyl-2H-imidazol-1-yl)phenyl]acridin-3-yl]-dimethyl-pyridin-2-ylsilane?
The canonical SMILES for [9,9-dimethyl-10-[3-(3-methyl-2H-imidazol-1-yl)phenyl]acridin-3-yl]-dimethyl-pyridin-2-ylsilane is CN1C=CN(c2cccc(N3c4ccccc4C(C)(C)c4ccc([Si](C)(C)c5ccccn5)cc43)c2)C1.
What is the InChIKey of [9,9-dimethyl-10-[3-(3-methyl-2H-imidazol-1-yl)phenyl]acridin-3-yl]-dimethyl-pyridin-2-ylsilane?
The InChIKey is VNUSGFDTUFLTAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H34N4Si/c1-32(2)27-13-6-7-14-29(27)36(25-12-10-11-24(21-25)35-20-19-34(3)23-35)30-22-26(16-17-28(30)32)37(4,5)31-15-8-9-18-33-31/h6-22H,23H2,1-5H3.
What are the key properties of [9,9-dimethyl-10-[3-(3-methyl-2H-imidazol-1-yl)phenyl]acridin-3-yl]-dimethyl-pyridin-2-ylsilane?
[9,9-dimethyl-10-[3-(3-methyl-2H-imidazol-1-yl)phenyl]acridin-3-yl]-dimethyl-pyridin-2-ylsilane has a molecular weight of 502.74 g/mol, XLogP of 6.19, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [9,9-dimethyl-10-[3-(3-methyl-2H-imidazol-1-yl)phenyl]acridin-3-yl]-dimethyl-pyridin-2-ylsilane is sourced from PubChem (CID 140717316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).