[4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane

C20H29NSi — CID 155611943

IUPAC[4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane
SMILESCc1cccc(-c2cc(CC(C)(C)C)c([Si](C)(C)C)cn2)c1
InChIInChI=1S/C20H29NSi/c1-15-9-8-10-16(11-15)18-12-17(13-20(2,3)4)19(14-21-18)22(5,6)7/h8-12,14H,13H2,1-7H3
InChIKeyHLHUKTSMKRIUNU-UHFFFAOYSA-N
MW311.55 g/mol
LogP5.19
Rot. Bonds3

About [4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane

[4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane (PubChem CID 155611943) has the molecular formula C20H29NSi and a molecular weight of 311.55 g/mol. Its IUPAC name is [4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane.

Molecular Properties

Compound Name[4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane
PubChem CID155611943
Molecular FormulaC20H29NSi
Molecular Weight311.55 g/mol
Exact Mass311.21
IUPAC Name[4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane
SMILESCc1cccc(-c2cc(CC(C)(C)C)c([Si](C)(C)C)cn2)c1
InChIInChI=1S/C20H29NSi/c1-15-9-8-10-16(11-15)18-12-17(13-20(2,3)4)19(14-21-18)22(5,6)7/h8-12,14H,13H2,1-7H3
InChIKeyHLHUKTSMKRIUNU-UHFFFAOYSA-N
XLogP5.19
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500311.55
LogP ≤ 55.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze [4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane 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

[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-(4-phenylphenyl)-3-pyridinyl]-trimethylsilane
CID 155612262
5-(2,2-dimethylpropyl)-4-methyl-2-phenylpyridine
CID 129022095
trimethyl-[4-pentyl-6-(3-phenylphenyl)-3-pyridinyl]silane
CID 140739178
(4-butyl-6-phenyl-3-pyridinyl)-trimethylsilane
CID 140738941
trimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane
CID 140710280
trimethyl-[6-(3-methylphenyl)-3-pyridinyl]silane
CID 166573501
4-(2,2-dimethylpropyl)-2-phenylpyridine;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;iridium;4-methyl-5-phenyl-2-(6-phenyldibenzofuran-2-yl)pyridine
CID 169038906
(4-tert-butyl-6-phenyl-3-pyridinyl)-trimethylsilane
CID 140710315
4-(2,2-dimethylpropyl)-5-methyl-2-(9-phenyl-3H-dibenzothiophen-3-id-2-yl)pyridine;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;iridium
CID 166574136
(4,6-diphenyl-3-pyridinyl)-trimethylsilane
CID 140710428
4-(2,2-dimethylpropyl)-5-methyl-2-(1-phenyldibenzofuran-4-yl)pyridine;4-(2,2-dimethylpropyl)-2-phenylpyridine;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;iridium
CID 169039106
4-(2-cyclopentylpropan-2-yl)-2-(9-phenyldibenzofuran-2-yl)pyridine;4-(2,2-dimethylpropyl)-2-phenylpyridine;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;iridium
CID 169039063

Frequently Asked Questions

What is the IUPAC name of [4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane?
The IUPAC name of [4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane (CID 155611943) is [4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane.
What is the SMILES notation for [4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane?
The canonical SMILES for [4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane is Cc1cccc(-c2cc(CC(C)(C)C)c([Si](C)(C)C)cn2)c1.
What is the InChIKey of [4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane?
The InChIKey is HLHUKTSMKRIUNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29NSi/c1-15-9-8-10-16(11-15)18-12-17(13-20(2,3)4)19(14-21-18)22(5,6)7/h8-12,14H,13H2,1-7H3.
What are the key properties of [4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane?
[4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane has a molecular weight of 311.55 g/mol, XLogP of 5.19, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,2-dimethylpropyl)-6-(3-methylphenyl)-3-pyridinyl]-trimethylsilane is sourced from PubChem (CID 155611943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).