[5-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane

C21H29NSi — CID 140739408

IUPAC[5-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane
SMILESC[Si](C)(C)c1cnc(-c2ccccc2)c(CC2CCCCC2)c1
InChIInChI=1S/C21H29NSi/c1-23(2,3)20-15-19(14-17-10-6-4-7-11-17)21(22-16-20)18-12-8-5-9-13-18/h5,8-9,12-13,15-17H,4,6-7,10-11,14H2,1-3H3
InChIKeyOIHIALGZXWTDTO-UHFFFAOYSA-N
MW323.56 g/mol
LogP5.42
Rot. Bonds4

About [5-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane

[5-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane (PubChem CID 140739408) has the molecular formula C21H29NSi and a molecular weight of 323.56 g/mol. Its IUPAC name is [5-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane.

Molecular Properties

Compound Name[5-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane
PubChem CID140739408
Molecular FormulaC21H29NSi
Molecular Weight323.56 g/mol
Exact Mass323.21
IUPAC Name[5-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane
SMILESC[Si](C)(C)c1cnc(-c2ccccc2)c(CC2CCCCC2)c1
InChIInChI=1S/C21H29NSi/c1-23(2,3)20-15-19(14-17-10-6-4-7-11-17)21(22-16-20)18-12-8-5-9-13-18/h5,8-9,12-13,15-17H,4,6-7,10-11,14H2,1-3H3
InChIKeyOIHIALGZXWTDTO-UHFFFAOYSA-N
XLogP5.42
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500323.56
LogP ≤ 55.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane
CID 140738962
[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane
CID 155611079
(5,6-diphenyl-3-pyridinyl)-trimethylsilane
CID 140739470
3-[4-(cyclohexylmethyl)-5-trimethylsilyl-2-pyridinyl]buta-1,3-dien-2-ol
CID 174111514
[4-(cyclohexylmethyl)-6-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-3-pyridinyl]-trimethylsilane
CID 166576367
3-cyclohexyl-5-(cyclohexylmethyl)-2,6-bis(4-fluorophenyl)pyridine
CID 135002722
[4-[2-(cycloheptylmethyl)-1H-inden-1-id-4-yl]phenyl]-trimethylsilane;dichlorozirconium
CID 89453317
[2-(cyclohexylmethyl)phenyl]methanamine
CID 105455805
1-chloro-2-(cyclohexylmethyl)benzene
CID 54348768
1-(cyclononylmethyl)anthracene
CID 173272600
3-(cyclohexylmethyl)-2-phenylimidazo[2,1-a]isoquinoline
CID 53299495
4-(cyclohexylmethyl)-2-(1-phenyl-3H-dibenzofuran-3-id-4-yl)pyridine;iridium;trimethyl-(6-phenyl-3-pyridinyl)silane
CID 166578804

Frequently Asked Questions

What is the IUPAC name of [5-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane?
The IUPAC name of [5-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane (CID 140739408) is [5-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane.
What is the SMILES notation for [5-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane?
The canonical SMILES for [5-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane is C[Si](C)(C)c1cnc(-c2ccccc2)c(CC2CCCCC2)c1.
What is the InChIKey of [5-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane?
The InChIKey is OIHIALGZXWTDTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29NSi/c1-23(2,3)20-15-19(14-17-10-6-4-7-11-17)21(22-16-20)18-12-8-5-9-13-18/h5,8-9,12-13,15-17H,4,6-7,10-11,14H2,1-3H3.
What are the key properties of [5-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane?
[5-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane has a molecular weight of 323.56 g/mol, XLogP of 5.42, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane is sourced from PubChem (CID 140739408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).