hydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane

C22H31NOSi — CID 171400301

IUPAChydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane
SMILESCC(C)(CCC1CCNCC1)[Si](O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H31NOSi/c1-22(2,16-13-19-14-17-23-18-15-19)25(24,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,19,23-24H,13-18H2,1-2H3
InChIKeyWSIJZSQHNYMMAN-UHFFFAOYSA-N
MW353.58 g/mol
LogP3.30
Rot. Bonds6

About hydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane

hydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane (PubChem CID 171400301) has the molecular formula C22H31NOSi and a molecular weight of 353.58 g/mol. Its IUPAC name is hydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane.

Molecular Properties

Compound Namehydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane
PubChem CID171400301
Molecular FormulaC22H31NOSi
Molecular Weight353.58 g/mol
Exact Mass353.22
IUPAC Namehydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane
SMILESCC(C)(CCC1CCNCC1)[Si](O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H31NOSi/c1-22(2,16-13-19-14-17-23-18-15-19)25(24,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,19,23-24H,13-18H2,1-2H3
InChIKeyWSIJZSQHNYMMAN-UHFFFAOYSA-N
XLogP3.30
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.58
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-Benzhydrylpiperidine
CID 88278
4-(Diphenylmethylene)piperidine
CID 2762533
3,4-Diphenylpiperidine
CID 14181131
Methoxy-diphenyl-piperidin-4-ylsilane
CID 12985302
3-Methyl-4-(dimethylphenylsilyl)piperidine
CID 14472570
2,5-Dimethyl-4-(triphenylsilyl)piperidine
CID 14472572
Benzyl(methyl)phenyl[(piperidin-1-ium-1-yl)methyl]silane bromide
CID 139087630
(3S,4S)-3-phenyl-4-[(1R)-1-phenylethyl]piperidin-1-ium chloride
CID 168335389
4-Benzhydrylidene-1-methylpiperidin-1-ium
CID 170849916
3,5-Dibenzylpiperidine
CID 413873
(3S,5S)-3-benzyl-5-(2-methylpropyl)piperidine
CID 10214533
(3S,5R)-3-ethyl-5-(3-phenylpropyl)piperidine
CID 10236142

Frequently Asked Questions

What is the IUPAC name of hydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane?
The IUPAC name of hydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane (CID 171400301) is hydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane.
What is the SMILES notation for hydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane?
The canonical SMILES for hydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane is CC(C)(CCC1CCNCC1)[Si](O)(c1ccccc1)c1ccccc1.
What is the InChIKey of hydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane?
The InChIKey is WSIJZSQHNYMMAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H31NOSi/c1-22(2,16-13-19-14-17-23-18-15-19)25(24,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,19,23-24H,13-18H2,1-2H3.
What are the key properties of hydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane?
hydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane has a molecular weight of 353.58 g/mol, XLogP of 3.30, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane is sourced from PubChem (CID 171400301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).