[cyclohexyl-phenyl-(2-pyrrolidin-1-ylethyl)silyl]methanol

C19H31NOSi — CID 10064439

IUPAC[cyclohexyl-phenyl-(2-pyrrolidin-1-ylethyl)silyl]methanol
SMILESOC[Si@@](CCN1CCCC1)(c1ccccc1)C1CCCCC1
InChIInChI=1S/C19H31NOSi/c21-17-22(18-9-3-1-4-10-18,19-11-5-2-6-12-19)16-15-20-13-7-8-14-20/h1,3-4,9-10,19,21H,2,5-8,11-17H2/t22-/m0/s1
InChIKeyNVISAUXILLGVTQ-QFIPXVFZSA-N
MW317.55 g/mol
LogP3.30
Rot. Bonds6

About [cyclohexyl-phenyl-(2-pyrrolidin-1-ylethyl)silyl]methanol

[cyclohexyl-phenyl-(2-pyrrolidin-1-ylethyl)silyl]methanol (PubChem CID 10064439) has the molecular formula C19H31NOSi and a molecular weight of 317.55 g/mol. Its IUPAC name is [cyclohexyl-phenyl-(2-pyrrolidin-1-ylethyl)silyl]methanol.

Molecular Properties

Compound Name[cyclohexyl-phenyl-(2-pyrrolidin-1-ylethyl)silyl]methanol
PubChem CID10064439
Molecular FormulaC19H31NOSi
Molecular Weight317.55 g/mol
Exact Mass317.22
IUPAC Name[cyclohexyl-phenyl-(2-pyrrolidin-1-ylethyl)silyl]methanol
SMILESOC[Si@@](CCN1CCCC1)(c1ccccc1)C1CCCCC1
InChIInChI=1S/C19H31NOSi/c21-17-22(18-9-3-1-4-10-18,19-11-5-2-6-12-19)16-15-20-13-7-8-14-20/h1,3-4,9-10,19,21H,2,5-8,11-17H2/t22-/m0/s1
InChIKeyNVISAUXILLGVTQ-QFIPXVFZSA-N
XLogP3.30
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.55
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(azepan-1-yl)ethyl-hydroxy-diphenylsilane
CID 71326153
hydroxy-diphenyl-(2-pyrrolidin-1-ylethyl)silane
CID 12539433
cyclohexyl-phenyl-bis(3-piperidin-1-ylprop-1-ynyl)silane
CID 3288270
1-(3,3-diphenylpropyl)azepane;hydrochloride
CID 3084164
1-(6,6-diphenylhexyl)piperidine
CID 161365973
(1S)-1-cyclopentyl-1-phenyl-3-piperidin-1-ylpropan-1-ol;hydrochloride
CID 46878511
6-phenylhexan-1-ol;1-(6-phenylhexyl)piperidine
CID 23016534
bis(bis[dicyclohexyl(phenyl)silyl]azanide);zirconium(4+);dichloride
CID 159721733
1-cyclohexyl-1-phenyl-5-piperidin-1-ylpent-2-yn-1-ol
CID 2835413
1-[3-cyclohexyloxy-3-(4-phenylphenyl)propyl]piperidine;hydrochloride
CID 23039558
(3R)-1-benzylazepan-3-ol
CID 124585423
phenyl-[(2S)-2-(2-piperidin-1-ylethyl)piperidin-1-yl]methanone
CID 40776058

Frequently Asked Questions

What is the IUPAC name of [cyclohexyl-phenyl-(2-pyrrolidin-1-ylethyl)silyl]methanol?
The IUPAC name of [cyclohexyl-phenyl-(2-pyrrolidin-1-ylethyl)silyl]methanol (CID 10064439) is [cyclohexyl-phenyl-(2-pyrrolidin-1-ylethyl)silyl]methanol.
What is the SMILES notation for [cyclohexyl-phenyl-(2-pyrrolidin-1-ylethyl)silyl]methanol?
The canonical SMILES for [cyclohexyl-phenyl-(2-pyrrolidin-1-ylethyl)silyl]methanol is OC[Si@@](CCN1CCCC1)(c1ccccc1)C1CCCCC1.
What is the InChIKey of [cyclohexyl-phenyl-(2-pyrrolidin-1-ylethyl)silyl]methanol?
The InChIKey is NVISAUXILLGVTQ-QFIPXVFZSA-N. The full InChI is InChI=1S/C19H31NOSi/c21-17-22(18-9-3-1-4-10-18,19-11-5-2-6-12-19)16-15-20-13-7-8-14-20/h1,3-4,9-10,19,21H,2,5-8,11-17H2/t22-/m0/s1.
What are the key properties of [cyclohexyl-phenyl-(2-pyrrolidin-1-ylethyl)silyl]methanol?
[cyclohexyl-phenyl-(2-pyrrolidin-1-ylethyl)silyl]methanol has a molecular weight of 317.55 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclohexyl-phenyl-(2-pyrrolidin-1-ylethyl)silyl]methanol is sourced from PubChem (CID 10064439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).