tert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane

C23H32OSi — CID 123161962

IUPACtert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane
SMILESCC1CCCC1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C23H32OSi/c1-19-12-11-13-20(19)18-24-25(23(2,3)4,21-14-7-5-8-15-21)22-16-9-6-10-17-22/h5-10,14-17,19-20H,11-13,18H2,1-4H3
InChIKeyJLUGRVXHOICXSD-UHFFFAOYSA-N
MW352.59 g/mol
LogP5.00
Rot. Bonds5

About tert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane

tert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane (PubChem CID 123161962) has the molecular formula C23H32OSi and a molecular weight of 352.59 g/mol. Its IUPAC name is tert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane.

Molecular Properties

Compound Nametert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane
PubChem CID123161962
Molecular FormulaC23H32OSi
Molecular Weight352.59 g/mol
Exact Mass352.22
IUPAC Nametert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane
SMILESCC1CCCC1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C23H32OSi/c1-19-12-11-13-20(19)18-24-25(23(2,3)4,21-14-7-5-8-15-21)22-16-9-6-10-17-22/h5-10,14-17,19-20H,11-13,18H2,1-4H3
InChIKeyJLUGRVXHOICXSD-UHFFFAOYSA-N
XLogP5.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.59
LogP ≤ 55.00
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

[(1R,2R)-2-(bromomethyl)cyclopentyl]methoxy-tert-butyl-diphenylsilane
CID 171429782
(2S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol
CID 174251063
2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol
CID 74035630
(2S,3S,4aR,6S,7S,8aS,9aR,10aR)-6,7-bis[[tert-butyl(diphenyl)silyl]oxymethyl]-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroanthracene-2,3-diol
CID 100959653
cis-(2S,3R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-N,N,3-trimethylcyclopentan-1-amine
CID 175638250
tert-butyl-[[4-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohexyl]methoxy]-diphenylsilane
CID 102242282
cis-(1R,2S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopropane-1-carbaldehyde;cis-(1S,2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopropane-1-carbaldehyde
CID 162119958
4-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-[(2-methylpropan-2-yl)oxy]cyclopentane-1,2-diol
CID 71138268
tert-butyl-[(2,6-dimethoxycyclohexa-2,5-dien-1-yl)methoxy]-diphenylsilane
CID 603410
tert-butyl-[[(2S)-oxolan-2-yl]methoxy]-diphenylsilane
CID 56616386
3-[[tert-butyl(diphenyl)silyl]oxymethyl]thian-4-ol
CID 122207177
2-[[(3R)-3-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclohexyl]methoxy]-2-methylpropanoic acid
CID 69058871

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane?
The IUPAC name of tert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane (CID 123161962) is tert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane.
What is the SMILES notation for tert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane?
The canonical SMILES for tert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane is CC1CCCC1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of tert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane?
The InChIKey is JLUGRVXHOICXSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32OSi/c1-19-12-11-13-20(19)18-24-25(23(2,3)4,21-14-7-5-8-15-21)22-16-9-6-10-17-22/h5-10,14-17,19-20H,11-13,18H2,1-4H3.
What are the key properties of tert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane?
tert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane has a molecular weight of 352.59 g/mol, XLogP of 5.00, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane is sourced from PubChem (CID 123161962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).